3,5-diamino-N-[8-(4-benzylmorpholine-2-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(7H-cyclopenta[b]pyridine-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(2,3-dihydro-1-benzofuran-5-yl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[(4,6-dimethoxypyrimidin-2-yl)methoxy]benzoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[2-(2,3-dimethyl-1H-indol-5-yl)acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-hydroxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1H-indole-2-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-methoxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1-methylindazole-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-methyl-2-phenylpyrimidine-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-phenylmethoxybenzoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1H-pyrrolo[2,3-b]pyridine-4-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(quinoline-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1,2,3-trimethylindole-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide

C319H356Cl14N126O36 — CID 161193236

IUPAC3,5-diamino-N-[8-(4-benzylmorpholine-2-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(7H-cyclopenta[b]pyridine-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(2,3-dihydro-1-benzofuran-5-yl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[(4,6-dimethoxypyrimidin-2-yl)methoxy]benzoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[2-(2,3-dimethyl-1H-indol-5-yl)acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-hydroxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1H-indole-2-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-methoxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1-methylindazole-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-methyl-2-phenylpyrimidine-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-phenylmethoxybenzoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1H-pyrrolo[2,3-b]pyridine-4-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(quinoline-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1,2,3-trimethylindole-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide
SMILESCOc1cc(OC)nc(COc2ccc(C(=O)N3CCC4(CC3)CN=C(NC(=O)c3nc(Cl)c(N)nc3N)N4)cc2)n1.COc1ccc(CCC(=O)N2CCC3(CC2)CN=C(NC(=O)c2nc(Cl)c(N)nc2N)N3)cc1.Cc1[nH]c2ccc(CC(=O)N3CCC4(CC3)CN=C(NC(=O)c3nc(Cl)c(N)nc3N)N4)cc2c1C.Cc1c(C)n(C)c2ccc(C(=O)N3CCC4(CC3)CN=C(NC(=O)c3nc(Cl)c(N)nc3N)N4)cc12.Cc1nc(-c2ccccc2)ncc1C(=O)N1CCC2(CC1)CN=C(NC(=O)c1nc(Cl)c(N)nc1N)N2.Cn1nc(C(=O)N2CCC3(CC2)CN=C(NC(=O)c2nc(Cl)c(N)nc2N)N3)c2ccccc21.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)C4CN(Cc5ccccc5)CCO4)CC3)N2)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)CCc4ccc(O)cc4)CC3)N2)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)CCc4ccc5c(c4)CCO5)CC3)N2)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)c4cc5ccccc5[nH]4)CC3)N2)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)c4ccc(OCc5ccccc5)cc4)CC3)N2)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)c4cccc5ncccc45)CC3)N2)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)c4ccnc5[nH]ccc45)CC3)N2)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)c4cnc5c(c4)C=CC5)CC3)N2)nc1Cl
InChIInChI=1S/C26H29ClN10O5.C26H27ClN8O3.C24H25ClN10O2.C24H30ClN9O3.2C24H28ClN9O2.C23H27ClN8O3.C22H22ClN9O2.C22H27ClN8O3.C21H23ClN10O2.2C21H22ClN9O2.C21H25ClN8O3.C20H21ClN10O2/c1-40-17-11-18(41-2)32-16(31-17)12-42-15-5-3-14(4-6-15)24(39)37-9-7-26(8-10-37)13-30-25(36-26)35-23(38)19-21(28)34-22(29)20(27)33-19;27-20-22(29)32-21(28)19(31-20)23(36)33-25-30-15-26(34-25)10-12-35(13-11-26)24(37)17-6-8-18(9-7-17)38-14-16-4-2-1-3-5-16;1-13-15(11-28-20(30-13)14-5-3-2-4-6-14)22(37)35-9-7-24(8-10-35)12-29-23(34-24)33-21(36)16-18(26)32-19(27)17(25)31-16;25-18-20(27)30-19(26)17(29-18)21(35)31-23-28-14-24(32-23)6-8-34(9-7-24)22(36)16-13-33(10-11-37-16)12-15-4-2-1-3-5-15;1-12-13(2)33(3)16-5-4-14(10-15(12)16)22(36)34-8-6-24(7-9-34)11-28-23(32-24)31-21(35)17-19(26)30-20(27)18(25)29-17;1-12-13(2)29-16-4-3-14(9-15(12)16)10-17(35)34-7-5-24(6-8-34)11-28-23(33-24)32-22(36)18-20(26)31-21(27)19(25)30-18;24-18-20(26)29-19(25)17(28-18)21(34)30-22-27-12-23(31-22)6-8-32(9-7-23)16(33)4-2-13-1-3-15-14(11-13)5-10-35-15;23-16-18(25)29-17(24)15(28-16)19(33)30-21-27-11-22(31-21)6-9-32(10-7-22)20(34)13-3-1-5-14-12(13)4-2-8-26-14;1-34-14-5-2-13(3-6-14)4-7-15(32)31-10-8-22(9-11-31)12-26-21(30-22)29-20(33)16-18(24)28-19(25)17(23)27-16;1-31-12-5-3-2-4-11(12)13(30-31)19(34)32-8-6-21(7-9-32)10-25-20(29-21)28-18(33)14-16(23)27-17(24)15(22)26-14;22-15-17(24)28-16(23)14(27-15)18(32)29-20-26-10-21(30-20)4-6-31(7-5-21)19(33)12-8-11-2-1-3-13(11)25-9-12;22-15-17(24)28-16(23)14(27-15)18(32)29-20-25-10-21(30-20)5-7-31(8-6-21)19(33)13-9-11-3-1-2-4-12(11)26-13;22-16-18(24)27-17(23)15(26-16)19(33)28-20-25-11-21(29-20)7-9-30(10-8-21)14(32)6-3-12-1-4-13(31)5-2-12;21-13-15(23)28-14(22)12(27-13)17(32)29-19-26-9-20(30-19)3-7-31(8-4-20)18(33)11-2-6-25-16-10(11)1-5-24-16/h3-6,11H,7-10,12-13H2,1-2H3,(H4,28,29,34)(H2,30,35,36,38);1-9H,10-15H2,(H4,28,29,32)(H2,30,33,34,36);2-6,11H,7-10,12H2,1H3,(H4,26,27,32)(H2,29,33,34,36);1-5,16H,6-14H2,(H4,26,27,30)(H2,28,31,32,35);4-5,10H,6-9,11H2,1-3H3,(H4,26,27,30)(H2,28,31,32,35);3-4,9,29H,5-8,10-11H2,1-2H3,(H4,26,27,31)(H2,28,32,33,36);1,3,11H,2,4-10,12H2,(H4,25,26,29)(H2,27,30,31,34);1-5,8H,6-7,9-11H2,(H4,24,25,29)(H2,27,30,31,33);2-3,5-6H,4,7-12H2,1H3,(H4,24,25,28)(H2,26,29,30,33);2-5H,6-10H2,1H3,(H4,23,24,27)(H2,25,28,29,33);1-2,8-9H,3-7,10H2,(H4,23,24,28)(H2,26,29,30,32);1-4,9,26H,5-8,10H2,(H4,23,24,28)(H2,25,29,30,32);1-2,4-5,31H,3,6-11H2,(H4,23,24,27)(H2,25,28,29,33);1-2,5-6H,3-4,7-9H2,(H,24,25)(H4,22,23,28)(H2,26,29,30,32)
InChIKeyUTZQTVDYTKHARY-UHFFFAOYSA-N
MW7027.55 g/mol
LogP15.03
Rot. Bonds47

About 3,5-diamino-N-[8-(4-benzylmorpholine-2-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(7H-cyclopenta[b]pyridine-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(2,3-dihydro-1-benzofuran-5-yl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[(4,6-dimethoxypyrimidin-2-yl)methoxy]benzoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[2-(2,3-dimethyl-1H-indol-5-yl)acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-hydroxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1H-indole-2-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-methoxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1-methylindazole-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-methyl-2-phenylpyrimidine-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-phenylmethoxybenzoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1H-pyrrolo[2,3-b]pyridine-4-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(quinoline-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1,2,3-trimethylindole-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide

3,5-diamino-N-[8-(4-benzylmorpholine-2-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(7H-cyclopenta[b]pyridine-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(2,3-dihydro-1-benzofuran-5-yl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[(4,6-dimethoxypyrimidin-2-yl)methoxy]benzoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[2-(2,3-dimethyl-1H-indol-5-yl)acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-hydroxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1H-indole-2-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-methoxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1-methylindazole-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-methyl-2-phenylpyrimidine-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-phenylmethoxybenzoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1H-pyrrolo[2,3-b]pyridine-4-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(quinoline-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1,2,3-trimethylindole-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide (PubChem CID 161193236) has the molecular formula C319H356Cl14N126O36 and a molecular weight of 7027.55 g/mol. Its IUPAC name is 3,5-diamino-N-[8-(4-benzylmorpholine-2-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(7H-cyclopenta[b]pyridine-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(2,3-dihydro-1-benzofuran-5-yl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[(4,6-dimethoxypyrimidin-2-yl)methoxy]benzoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[2-(2,3-dimethyl-1H-indol-5-yl)acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-hydroxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1H-indole-2-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-methoxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1-methylindazole-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-methyl-2-phenylpyrimidine-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-phenylmethoxybenzoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1H-pyrrolo[2,3-b]pyridine-4-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(quinoline-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1,2,3-trimethylindole-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide.

Molecular Properties

Compound Name3,5-diamino-N-[8-(4-benzylmorpholine-2-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(7H-cyclopenta[b]pyridine-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(2,3-dihydro-1-benzofuran-5-yl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[(4,6-dimethoxypyrimidin-2-yl)methoxy]benzoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[2-(2,3-dimethyl-1H-indol-5-yl)acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-hydroxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1H-indole-2-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-methoxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1-methylindazole-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-methyl-2-phenylpyrimidine-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-phenylmethoxybenzoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1H-pyrrolo[2,3-b]pyridine-4-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(quinoline-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1,2,3-trimethylindole-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide
PubChem CID161193236
Molecular FormulaC319H356Cl14N126O36
Molecular Weight7027.55 g/mol
Exact Mass7016.55
IUPAC Name3,5-diamino-N-[8-(4-benzylmorpholine-2-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(7H-cyclopenta[b]pyridine-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(2,3-dihydro-1-benzofuran-5-yl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[(4,6-dimethoxypyrimidin-2-yl)methoxy]benzoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[2-(2,3-dimethyl-1H-indol-5-yl)acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-hydroxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1H-indole-2-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-methoxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1-methylindazole-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-methyl-2-phenylpyrimidine-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-phenylmethoxybenzoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1H-pyrrolo[2,3-b]pyridine-4-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(quinoline-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1,2,3-trimethylindole-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide
SMILESCOc1cc(OC)nc(COc2ccc(C(=O)N3CCC4(CC3)CN=C(NC(=O)c3nc(Cl)c(N)nc3N)N4)cc2)n1.COc1ccc(CCC(=O)N2CCC3(CC2)CN=C(NC(=O)c2nc(Cl)c(N)nc2N)N3)cc1.Cc1[nH]c2ccc(CC(=O)N3CCC4(CC3)CN=C(NC(=O)c3nc(Cl)c(N)nc3N)N4)cc2c1C.Cc1c(C)n(C)c2ccc(C(=O)N3CCC4(CC3)CN=C(NC(=O)c3nc(Cl)c(N)nc3N)N4)cc12.Cc1nc(-c2ccccc2)ncc1C(=O)N1CCC2(CC1)CN=C(NC(=O)c1nc(Cl)c(N)nc1N)N2.Cn1nc(C(=O)N2CCC3(CC2)CN=C(NC(=O)c2nc(Cl)c(N)nc2N)N3)c2ccccc21.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)C4CN(Cc5ccccc5)CCO4)CC3)N2)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)CCc4ccc(O)cc4)CC3)N2)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)CCc4ccc5c(c4)CCO5)CC3)N2)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)c4cc5ccccc5[nH]4)CC3)N2)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)c4ccc(OCc5ccccc5)cc4)CC3)N2)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)c4cccc5ncccc45)CC3)N2)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)c4ccnc5[nH]ccc45)CC3)N2)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)c4cnc5c(c4)C=CC5)CC3)N2)nc1Cl
InChIInChI=1S/C26H29ClN10O5.C26H27ClN8O3.C24H25ClN10O2.C24H30ClN9O3.2C24H28ClN9O2.C23H27ClN8O3.C22H22ClN9O2.C22H27ClN8O3.C21H23ClN10O2.2C21H22ClN9O2.C21H25ClN8O3.C20H21ClN10O2/c1-40-17-11-18(41-2)32-16(31-17)12-42-15-5-3-14(4-6-15)24(39)37-9-7-26(8-10-37)13-30-25(36-26)35-23(38)19-21(28)34-22(29)20(27)33-19;27-20-22(29)32-21(28)19(31-20)23(36)33-25-30-15-26(34-25)10-12-35(13-11-26)24(37)17-6-8-18(9-7-17)38-14-16-4-2-1-3-5-16;1-13-15(11-28-20(30-13)14-5-3-2-4-6-14)22(37)35-9-7-24(8-10-35)12-29-23(34-24)33-21(36)16-18(26)32-19(27)17(25)31-16;25-18-20(27)30-19(26)17(29-18)21(35)31-23-28-14-24(32-23)6-8-34(9-7-24)22(36)16-13-33(10-11-37-16)12-15-4-2-1-3-5-15;1-12-13(2)33(3)16-5-4-14(10-15(12)16)22(36)34-8-6-24(7-9-34)11-28-23(32-24)31-21(35)17-19(26)30-20(27)18(25)29-17;1-12-13(2)29-16-4-3-14(9-15(12)16)10-17(35)34-7-5-24(6-8-34)11-28-23(33-24)32-22(36)18-20(26)31-21(27)19(25)30-18;24-18-20(26)29-19(25)17(28-18)21(34)30-22-27-12-23(31-22)6-8-32(9-7-23)16(33)4-2-13-1-3-15-14(11-13)5-10-35-15;23-16-18(25)29-17(24)15(28-16)19(33)30-21-27-11-22(31-21)6-9-32(10-7-22)20(34)13-3-1-5-14-12(13)4-2-8-26-14;1-34-14-5-2-13(3-6-14)4-7-15(32)31-10-8-22(9-11-31)12-26-21(30-22)29-20(33)16-18(24)28-19(25)17(23)27-16;1-31-12-5-3-2-4-11(12)13(30-31)19(34)32-8-6-21(7-9-32)10-25-20(29-21)28-18(33)14-16(23)27-17(24)15(22)26-14;22-15-17(24)28-16(23)14(27-15)18(32)29-20-26-10-21(30-20)4-6-31(7-5-21)19(33)12-8-11-2-1-3-13(11)25-9-12;22-15-17(24)28-16(23)14(27-15)18(32)29-20-25-10-21(30-20)5-7-31(8-6-21)19(33)13-9-11-3-1-2-4-12(11)26-13;22-16-18(24)27-17(23)15(26-16)19(33)28-20-25-11-21(29-20)7-9-30(10-8-21)14(32)6-3-12-1-4-13(31)5-2-12;21-13-15(23)28-14(22)12(27-13)17(32)29-19-26-9-20(30-19)3-7-31(8-4-20)18(33)11-2-6-25-16-10(11)1-5-24-16/h3-6,11H,7-10,12-13H2,1-2H3,(H4,28,29,34)(H2,30,35,36,38);1-9H,10-15H2,(H4,28,29,32)(H2,30,33,34,36);2-6,11H,7-10,12H2,1H3,(H4,26,27,32)(H2,29,33,34,36);1-5,16H,6-14H2,(H4,26,27,30)(H2,28,31,32,35);4-5,10H,6-9,11H2,1-3H3,(H4,26,27,30)(H2,28,31,32,35);3-4,9,29H,5-8,10-11H2,1-2H3,(H4,26,27,31)(H2,28,32,33,36);1,3,11H,2,4-10,12H2,(H4,25,26,29)(H2,27,30,31,34);1-5,8H,6-7,9-11H2,(H4,24,25,29)(H2,27,30,31,33);2-3,5-6H,4,7-12H2,1H3,(H4,24,25,28)(H2,26,29,30,33);2-5H,6-10H2,1H3,(H4,23,24,27)(H2,25,28,29,33);1-2,8-9H,3-7,10H2,(H4,23,24,28)(H2,26,29,30,32);1-4,9,26H,5-8,10H2,(H4,23,24,28)(H2,25,29,30,32);1-2,4-5,31H,3,6-11H2,(H4,23,24,27)(H2,25,28,29,33);1-2,5-6H,3-4,7-9H2,(H,24,25)(H4,22,23,28)(H2,26,29,30,32)
InChIKeyUTZQTVDYTKHARY-UHFFFAOYSA-N
XLogP15.03
TPSA2371.11 Ų
H-Bond Donors60
H-Bond Acceptors131
Rotatable Bonds47
Heavy Atoms495
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5007027.55
LogP ≤ 515.03
H-Bond Donors ≤ 560
H-Bond Acceptors ≤ 10131

Analyze 3,5-diamino-N-[8-(4-benzylmorpholine-2-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(7H-cyclopenta[b]pyridine-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(2,3-dihydro-1-benzofuran-5-yl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[(4,6-dimethoxypyrimidin-2-yl)methoxy]benzoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[2-(2,3-dimethyl-1H-indol-5-yl)acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-hydroxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1H-indole-2-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-methoxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1-methylindazole-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-methyl-2-phenylpyrimidine-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-phenylmethoxybenzoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1H-pyrrolo[2,3-b]pyridine-4-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(quinoline-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1,2,3-trimethylindole-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3,5-diamino-N-[8-(4-benzylmorpholine-2-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(7H-cyclopenta[b]pyridine-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(2,3-dihydro-1-benzofuran-5-yl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[(4,6-dimethoxypyrimidin-2-yl)methoxy]benzoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[2-(2,3-dimethyl-1H-indol-5-yl)acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-hydroxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1H-indole-2-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-methoxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1-methylindazole-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-methyl-2-phenylpyrimidine-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-phenylmethoxybenzoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1H-pyrrolo[2,3-b]pyridine-4-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(quinoline-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1,2,3-trimethylindole-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide?
The IUPAC name of 3,5-diamino-N-[8-(4-benzylmorpholine-2-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(7H-cyclopenta[b]pyridine-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(2,3-dihydro-1-benzofuran-5-yl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[(4,6-dimethoxypyrimidin-2-yl)methoxy]benzoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[2-(2,3-dimethyl-1H-indol-5-yl)acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-hydroxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1H-indole-2-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-methoxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1-methylindazole-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-methyl-2-phenylpyrimidine-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-phenylmethoxybenzoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1H-pyrrolo[2,3-b]pyridine-4-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(quinoline-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1,2,3-trimethylindole-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide (CID 161193236) is 3,5-diamino-N-[8-(4-benzylmorpholine-2-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(7H-cyclopenta[b]pyridine-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(2,3-dihydro-1-benzofuran-5-yl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[(4,6-dimethoxypyrimidin-2-yl)methoxy]benzoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[2-(2,3-dimethyl-1H-indol-5-yl)acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-hydroxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1H-indole-2-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-methoxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1-methylindazole-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-methyl-2-phenylpyrimidine-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-phenylmethoxybenzoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1H-pyrrolo[2,3-b]pyridine-4-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(quinoline-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1,2,3-trimethylindole-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide.
What is the SMILES notation for 3,5-diamino-N-[8-(4-benzylmorpholine-2-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(7H-cyclopenta[b]pyridine-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(2,3-dihydro-1-benzofuran-5-yl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[(4,6-dimethoxypyrimidin-2-yl)methoxy]benzoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[2-(2,3-dimethyl-1H-indol-5-yl)acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-hydroxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1H-indole-2-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-methoxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1-methylindazole-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-methyl-2-phenylpyrimidine-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-phenylmethoxybenzoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1H-pyrrolo[2,3-b]pyridine-4-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(quinoline-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1,2,3-trimethylindole-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide?
The canonical SMILES for 3,5-diamino-N-[8-(4-benzylmorpholine-2-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(7H-cyclopenta[b]pyridine-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(2,3-dihydro-1-benzofuran-5-yl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[(4,6-dimethoxypyrimidin-2-yl)methoxy]benzoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[2-(2,3-dimethyl-1H-indol-5-yl)acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-hydroxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1H-indole-2-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-methoxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1-methylindazole-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-methyl-2-phenylpyrimidine-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-phenylmethoxybenzoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1H-pyrrolo[2,3-b]pyridine-4-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(quinoline-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1,2,3-trimethylindole-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide is COc1cc(OC)nc(COc2ccc(C(=O)N3CCC4(CC3)CN=C(NC(=O)c3nc(Cl)c(N)nc3N)N4)cc2)n1.COc1ccc(CCC(=O)N2CCC3(CC2)CN=C(NC(=O)c2nc(Cl)c(N)nc2N)N3)cc1.Cc1[nH]c2ccc(CC(=O)N3CCC4(CC3)CN=C(NC(=O)c3nc(Cl)c(N)nc3N)N4)cc2c1C.Cc1c(C)n(C)c2ccc(C(=O)N3CCC4(CC3)CN=C(NC(=O)c3nc(Cl)c(N)nc3N)N4)cc12.Cc1nc(-c2ccccc2)ncc1C(=O)N1CCC2(CC1)CN=C(NC(=O)c1nc(Cl)c(N)nc1N)N2.Cn1nc(C(=O)N2CCC3(CC2)CN=C(NC(=O)c2nc(Cl)c(N)nc2N)N3)c2ccccc21.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)C4CN(Cc5ccccc5)CCO4)CC3)N2)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)CCc4ccc(O)cc4)CC3)N2)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)CCc4ccc5c(c4)CCO5)CC3)N2)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)c4cc5ccccc5[nH]4)CC3)N2)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)c4ccc(OCc5ccccc5)cc4)CC3)N2)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)c4cccc5ncccc45)CC3)N2)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)c4ccnc5[nH]ccc45)CC3)N2)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)c4cnc5c(c4)C=CC5)CC3)N2)nc1Cl.
What is the InChIKey of 3,5-diamino-N-[8-(4-benzylmorpholine-2-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(7H-cyclopenta[b]pyridine-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(2,3-dihydro-1-benzofuran-5-yl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[(4,6-dimethoxypyrimidin-2-yl)methoxy]benzoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[2-(2,3-dimethyl-1H-indol-5-yl)acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-hydroxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1H-indole-2-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-methoxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1-methylindazole-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-methyl-2-phenylpyrimidine-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-phenylmethoxybenzoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1H-pyrrolo[2,3-b]pyridine-4-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(quinoline-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1,2,3-trimethylindole-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide?
The InChIKey is UTZQTVDYTKHARY-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H29ClN10O5.C26H27ClN8O3.C24H25ClN10O2.C24H30ClN9O3.2C24H28ClN9O2.C23H27ClN8O3.C22H22ClN9O2.C22H27ClN8O3.C21H23ClN10O2.2C21H22ClN9O2.C21H25ClN8O3.C20H21ClN10O2/c1-40-17-11-18(41-2)32-16(31-17)12-42-15-5-3-14(4-6-15)24(39)37-9-7-26(8-10-37)13-30-25(36-26)35-23(38)19-21(28)34-22(29)20(27)33-19;27-20-22(29)32-21(28)19(31-20)23(36)33-25-30-15-26(34-25)10-12-35(13-11-26)24(37)17-6-8-18(9-7-17)38-14-16-4-2-1-3-5-16;1-13-15(11-28-20(30-13)14-5-3-2-4-6-14)22(37)35-9-7-24(8-10-35)12-29-23(34-24)33-21(36)16-18(26)32-19(27)17(25)31-16;25-18-20(27)30-19(26)17(29-18)21(35)31-23-28-14-24(32-23)6-8-34(9-7-24)22(36)16-13-33(10-11-37-16)12-15-4-2-1-3-5-15;1-12-13(2)33(3)16-5-4-14(10-15(12)16)22(36)34-8-6-24(7-9-34)11-28-23(32-24)31-21(35)17-19(26)30-20(27)18(25)29-17;1-12-13(2)29-16-4-3-14(9-15(12)16)10-17(35)34-7-5-24(6-8-34)11-28-23(33-24)32-22(36)18-20(26)31-21(27)19(25)30-18;24-18-20(26)29-19(25)17(28-18)21(34)30-22-27-12-23(31-22)6-8-32(9-7-23)16(33)4-2-13-1-3-15-14(11-13)5-10-35-15;23-16-18(25)29-17(24)15(28-16)19(33)30-21-27-11-22(31-21)6-9-32(10-7-22)20(34)13-3-1-5-14-12(13)4-2-8-26-14;1-34-14-5-2-13(3-6-14)4-7-15(32)31-10-8-22(9-11-31)12-26-21(30-22)29-20(33)16-18(24)28-19(25)17(23)27-16;1-31-12-5-3-2-4-11(12)13(30-31)19(34)32-8-6-21(7-9-32)10-25-20(29-21)28-18(33)14-16(23)27-17(24)15(22)26-14;22-15-17(24)28-16(23)14(27-15)18(32)29-20-26-10-21(30-20)4-6-31(7-5-21)19(33)12-8-11-2-1-3-13(11)25-9-12;22-15-17(24)28-16(23)14(27-15)18(32)29-20-25-10-21(30-20)5-7-31(8-6-21)19(33)13-9-11-3-1-2-4-12(11)26-13;22-16-18(24)27-17(23)15(26-16)19(33)28-20-25-11-21(29-20)7-9-30(10-8-21)14(32)6-3-12-1-4-13(31)5-2-12;21-13-15(23)28-14(22)12(27-13)17(32)29-19-26-9-20(30-19)3-7-31(8-4-20)18(33)11-2-6-25-16-10(11)1-5-24-16/h3-6,11H,7-10,12-13H2,1-2H3,(H4,28,29,34)(H2,30,35,36,38);1-9H,10-15H2,(H4,28,29,32)(H2,30,33,34,36);2-6,11H,7-10,12H2,1H3,(H4,26,27,32)(H2,29,33,34,36);1-5,16H,6-14H2,(H4,26,27,30)(H2,28,31,32,35);4-5,10H,6-9,11H2,1-3H3,(H4,26,27,30)(H2,28,31,32,35);3-4,9,29H,5-8,10-11H2,1-2H3,(H4,26,27,31)(H2,28,32,33,36);1,3,11H,2,4-10,12H2,(H4,25,26,29)(H2,27,30,31,34);1-5,8H,6-7,9-11H2,(H4,24,25,29)(H2,27,30,31,33);2-3,5-6H,4,7-12H2,1H3,(H4,24,25,28)(H2,26,29,30,33);2-5H,6-10H2,1H3,(H4,23,24,27)(H2,25,28,29,33);1-2,8-9H,3-7,10H2,(H4,23,24,28)(H2,26,29,30,32);1-4,9,26H,5-8,10H2,(H4,23,24,28)(H2,25,29,30,32);1-2,4-5,31H,3,6-11H2,(H4,23,24,27)(H2,25,28,29,33);1-2,5-6H,3-4,7-9H2,(H,24,25)(H4,22,23,28)(H2,26,29,30,32).
What are the key properties of 3,5-diamino-N-[8-(4-benzylmorpholine-2-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(7H-cyclopenta[b]pyridine-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(2,3-dihydro-1-benzofuran-5-yl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[(4,6-dimethoxypyrimidin-2-yl)methoxy]benzoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[2-(2,3-dimethyl-1H-indol-5-yl)acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-hydroxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1H-indole-2-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-methoxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1-methylindazole-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-methyl-2-phenylpyrimidine-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-phenylmethoxybenzoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1H-pyrrolo[2,3-b]pyridine-4-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(quinoline-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1,2,3-trimethylindole-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide?
3,5-diamino-N-[8-(4-benzylmorpholine-2-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(7H-cyclopenta[b]pyridine-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(2,3-dihydro-1-benzofuran-5-yl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[(4,6-dimethoxypyrimidin-2-yl)methoxy]benzoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[2-(2,3-dimethyl-1H-indol-5-yl)acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-hydroxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1H-indole-2-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-methoxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1-methylindazole-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-methyl-2-phenylpyrimidine-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-phenylmethoxybenzoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1H-pyrrolo[2,3-b]pyridine-4-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(quinoline-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1,2,3-trimethylindole-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide has a molecular weight of 7027.55 g/mol, XLogP of 15.03, 47 rotatable bonds, 60 hydrogen bond donors, and 131 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-diamino-N-[8-(4-benzylmorpholine-2-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(7H-cyclopenta[b]pyridine-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(2,3-dihydro-1-benzofuran-5-yl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[4-[(4,6-dimethoxypyrimidin-2-yl)methoxy]benzoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[2-(2,3-dimethyl-1H-indol-5-yl)acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-hydroxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1H-indole-2-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-methoxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1-methylindazole-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-methyl-2-phenylpyrimidine-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-phenylmethoxybenzoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1H-pyrrolo[2,3-b]pyridine-4-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(quinoline-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1,2,3-trimethylindole-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide is sourced from PubChem (CID 161193236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).