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-[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-[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-[2-[4-(2-methoxyethoxymethoxy)phenyl]acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-[4-(2-methoxyethoxymethoxy)phenyl]propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[6-(4-methyl-2-oxopentyl)pyridine-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-[2-(propan-2-ylcarbamoylamino)pyridine-4-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-prop-2-enoxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;bis(4-[2-[(3,5-diamino-6-chloropyrazine-2-carbonyl)amino]-1,3,8-triazaspiro[4.5]dec-2-ene-8-carbonyl]-N-propan-2-ylindole-1-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

C328H384Cl14N128O44 — CID 159393783

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-[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-[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-[2-[4-(2-methoxyethoxymethoxy)phenyl]acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-[4-(2-methoxyethoxymethoxy)phenyl]propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[6-(4-methyl-2-oxopentyl)pyridine-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-[2-(propan-2-ylcarbamoylamino)pyridine-4-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-prop-2-enoxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;bis(4-[2-[(3,5-diamino-6-chloropyrazine-2-carbonyl)amino]-1,3,8-triazaspiro[4.5]dec-2-ene-8-carbonyl]-N-propan-2-ylindole-1-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
SMILESC=CCOc1ccc(CCC(=O)N2CCC3(CC2)CN=C(NC(=O)c2nc(Cl)c(N)nc2N)N3)cc1.CC(C)CC(=O)Cc1ccc(C(=O)N2CCC3(CC2)CN=C(NC(=O)c2nc(Cl)c(N)nc2N)N3)cn1.CC(C)NC(=O)Nc1cc(C(=O)N2CCC3(CC2)CN=C(NC(=O)c2nc(Cl)c(N)nc2N)N3)ccn1.CC(C)NC(=O)n1ccc2c(C(=O)N3CCC4(CC3)CN=C(NC(=O)c3nc(Cl)c(N)nc3N)N4)cccc21.CC(C)NC(=O)n1ccc2c(C(=O)N3CCC4(CC3)CN=C(NC(=O)c3nc(Cl)c(N)nc3N)N4)cccc21.COCCOCOc1ccc(CC(=O)N2CCC3(CC2)CN=C(NC(=O)c2nc(Cl)c(N)nc2N)N3)cc1.COCCOCOc1ccc(CCC(=O)N2CCC3(CC2)CN=C(NC(=O)c2nc(Cl)c(N)nc2N)N3)cc1.COc1cc(OC)nc(COc2ccc(C(=O)N3CCC4(CC3)CN=C(NC(=O)c3nc(Cl)c(N)nc3N)N4)cc2)n1.Cc1nc(-c2ccccc2)ncc1C(=O)N1CCC2(CC1)CN=C(NC(=O)c1nc(Cl)c(N)nc1N)N2.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)c4cc5ccccc5[nH]4)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)c4cnc5c(c4)C=CC5)CC3)N2)nc1Cl
InChIInChI=1S/C26H29ClN10O5.2C25H29ClN10O3.C25H33ClN8O5.C24H25ClN10O2.2C24H30ClN9O3.C24H31ClN8O5.C24H29ClN8O3.C22H28ClN11O3.C22H22ClN9O2.2C21H22ClN9O2.C21H25ClN8O3/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;2*1-13(2)30-24(39)36-9-6-14-15(4-3-5-16(14)36)22(38)35-10-7-25(8-11-35)12-29-23(34-25)33-21(37)17-19(27)32-20(28)18(26)31-17;1-37-12-13-38-15-39-17-5-2-16(3-6-17)4-7-18(35)34-10-8-25(9-11-34)14-29-24(33-25)32-23(36)19-21(27)31-22(28)20(26)30-19;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;1-13(2)9-16(35)10-15-4-3-14(11-28-15)22(37)34-7-5-24(6-8-34)12-29-23(33-24)32-21(36)17-19(26)31-20(27)18(25)30-17;1-36-10-11-37-14-38-16-4-2-15(3-5-16)12-17(34)33-8-6-24(7-9-33)13-28-23(32-24)31-22(35)18-20(26)30-21(27)19(25)29-18;1-2-13-36-16-6-3-15(4-7-16)5-8-17(34)33-11-9-24(10-12-33)14-28-23(32-24)31-22(35)18-20(26)30-21(27)19(25)29-18;1-11(2)28-21(37)29-13-9-12(3-6-26-13)19(36)34-7-4-22(5-8-34)10-27-20(33-22)32-18(35)14-16(24)31-17(25)15(23)30-14;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;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/h3-6,11H,7-10,12-13H2,1-2H3,(H4,28,29,34)(H2,30,35,36,38);2*3-6,9,13H,7-8,10-12H2,1-2H3,(H,30,39)(H4,27,28,32)(H2,29,33,34,37);2-3,5-6H,4,7-15H2,1H3,(H4,27,28,31)(H2,29,32,33,36);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);3-4,11,13H,5-10,12H2,1-2H3,(H4,26,27,31)(H2,29,32,33,36);2-5H,6-14H2,1H3,(H4,26,27,30)(H2,28,31,32,35);2-4,6-7H,1,5,8-14H2,(H4,26,27,30)(H2,28,31,32,35);3,6,9,11H,4-5,7-8,10H2,1-2H3,(H4,24,25,31)(H2,26,28,29,37)(H2,27,32,33,35);1-5,8H,6-7,9-11H2,(H4,24,25,29)(H2,27,30,31,33);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)
InChIKeyLMLLREWPUHPVRU-UHFFFAOYSA-N
MW7319.87 g/mol
LogP14.42
Rot. Bonds66

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-[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-[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-[2-[4-(2-methoxyethoxymethoxy)phenyl]acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-[4-(2-methoxyethoxymethoxy)phenyl]propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[6-(4-methyl-2-oxopentyl)pyridine-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-[2-(propan-2-ylcarbamoylamino)pyridine-4-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-prop-2-enoxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;bis(4-[2-[(3,5-diamino-6-chloropyrazine-2-carbonyl)amino]-1,3,8-triazaspiro[4.5]dec-2-ene-8-carbonyl]-N-propan-2-ylindole-1-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-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-[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-[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-[2-[4-(2-methoxyethoxymethoxy)phenyl]acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-[4-(2-methoxyethoxymethoxy)phenyl]propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[6-(4-methyl-2-oxopentyl)pyridine-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-[2-(propan-2-ylcarbamoylamino)pyridine-4-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-prop-2-enoxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;bis(4-[2-[(3,5-diamino-6-chloropyrazine-2-carbonyl)amino]-1,3,8-triazaspiro[4.5]dec-2-ene-8-carbonyl]-N-propan-2-ylindole-1-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 (PubChem CID 159393783) has the molecular formula C328H384Cl14N128O44 and a molecular weight of 7319.87 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-[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-[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-[2-[4-(2-methoxyethoxymethoxy)phenyl]acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-[4-(2-methoxyethoxymethoxy)phenyl]propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[6-(4-methyl-2-oxopentyl)pyridine-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-[2-(propan-2-ylcarbamoylamino)pyridine-4-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-prop-2-enoxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;bis(4-[2-[(3,5-diamino-6-chloropyrazine-2-carbonyl)amino]-1,3,8-triazaspiro[4.5]dec-2-ene-8-carbonyl]-N-propan-2-ylindole-1-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.

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-[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-[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-[2-[4-(2-methoxyethoxymethoxy)phenyl]acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-[4-(2-methoxyethoxymethoxy)phenyl]propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[6-(4-methyl-2-oxopentyl)pyridine-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-[2-(propan-2-ylcarbamoylamino)pyridine-4-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-prop-2-enoxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;bis(4-[2-[(3,5-diamino-6-chloropyrazine-2-carbonyl)amino]-1,3,8-triazaspiro[4.5]dec-2-ene-8-carbonyl]-N-propan-2-ylindole-1-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
PubChem CID159393783
Molecular FormulaC328H384Cl14N128O44
Molecular Weight7319.87 g/mol
Exact Mass7308.74
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-[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-[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-[2-[4-(2-methoxyethoxymethoxy)phenyl]acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-[4-(2-methoxyethoxymethoxy)phenyl]propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[6-(4-methyl-2-oxopentyl)pyridine-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-[2-(propan-2-ylcarbamoylamino)pyridine-4-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-prop-2-enoxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;bis(4-[2-[(3,5-diamino-6-chloropyrazine-2-carbonyl)amino]-1,3,8-triazaspiro[4.5]dec-2-ene-8-carbonyl]-N-propan-2-ylindole-1-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
SMILESC=CCOc1ccc(CCC(=O)N2CCC3(CC2)CN=C(NC(=O)c2nc(Cl)c(N)nc2N)N3)cc1.CC(C)CC(=O)Cc1ccc(C(=O)N2CCC3(CC2)CN=C(NC(=O)c2nc(Cl)c(N)nc2N)N3)cn1.CC(C)NC(=O)Nc1cc(C(=O)N2CCC3(CC2)CN=C(NC(=O)c2nc(Cl)c(N)nc2N)N3)ccn1.CC(C)NC(=O)n1ccc2c(C(=O)N3CCC4(CC3)CN=C(NC(=O)c3nc(Cl)c(N)nc3N)N4)cccc21.CC(C)NC(=O)n1ccc2c(C(=O)N3CCC4(CC3)CN=C(NC(=O)c3nc(Cl)c(N)nc3N)N4)cccc21.COCCOCOc1ccc(CC(=O)N2CCC3(CC2)CN=C(NC(=O)c2nc(Cl)c(N)nc2N)N3)cc1.COCCOCOc1ccc(CCC(=O)N2CCC3(CC2)CN=C(NC(=O)c2nc(Cl)c(N)nc2N)N3)cc1.COc1cc(OC)nc(COc2ccc(C(=O)N3CCC4(CC3)CN=C(NC(=O)c3nc(Cl)c(N)nc3N)N4)cc2)n1.Cc1nc(-c2ccccc2)ncc1C(=O)N1CCC2(CC1)CN=C(NC(=O)c1nc(Cl)c(N)nc1N)N2.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)c4cc5ccccc5[nH]4)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)c4cnc5c(c4)C=CC5)CC3)N2)nc1Cl
InChIInChI=1S/C26H29ClN10O5.2C25H29ClN10O3.C25H33ClN8O5.C24H25ClN10O2.2C24H30ClN9O3.C24H31ClN8O5.C24H29ClN8O3.C22H28ClN11O3.C22H22ClN9O2.2C21H22ClN9O2.C21H25ClN8O3/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;2*1-13(2)30-24(39)36-9-6-14-15(4-3-5-16(14)36)22(38)35-10-7-25(8-11-35)12-29-23(34-25)33-21(37)17-19(27)32-20(28)18(26)31-17;1-37-12-13-38-15-39-17-5-2-16(3-6-17)4-7-18(35)34-10-8-25(9-11-34)14-29-24(33-25)32-23(36)19-21(27)31-22(28)20(26)30-19;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;1-13(2)9-16(35)10-15-4-3-14(11-28-15)22(37)34-7-5-24(6-8-34)12-29-23(33-24)32-21(36)17-19(26)31-20(27)18(25)30-17;1-36-10-11-37-14-38-16-4-2-15(3-5-16)12-17(34)33-8-6-24(7-9-33)13-28-23(32-24)31-22(35)18-20(26)30-21(27)19(25)29-18;1-2-13-36-16-6-3-15(4-7-16)5-8-17(34)33-11-9-24(10-12-33)14-28-23(32-24)31-22(35)18-20(26)30-21(27)19(25)29-18;1-11(2)28-21(37)29-13-9-12(3-6-26-13)19(36)34-7-4-22(5-8-34)10-27-20(33-22)32-18(35)14-16(24)31-17(25)15(23)30-14;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;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/h3-6,11H,7-10,12-13H2,1-2H3,(H4,28,29,34)(H2,30,35,36,38);2*3-6,9,13H,7-8,10-12H2,1-2H3,(H,30,39)(H4,27,28,32)(H2,29,33,34,37);2-3,5-6H,4,7-15H2,1H3,(H4,27,28,31)(H2,29,32,33,36);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);3-4,11,13H,5-10,12H2,1-2H3,(H4,26,27,31)(H2,29,32,33,36);2-5H,6-14H2,1H3,(H4,26,27,30)(H2,28,31,32,35);2-4,6-7H,1,5,8-14H2,(H4,26,27,30)(H2,28,31,32,35);3,6,9,11H,4-5,7-8,10H2,1-2H3,(H4,24,25,31)(H2,26,28,29,37)(H2,27,32,33,35);1-5,8H,6-7,9-11H2,(H4,24,25,29)(H2,27,30,31,33);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)
InChIKeyLMLLREWPUHPVRU-UHFFFAOYSA-N
XLogP14.42
TPSA2492.85 Ų
H-Bond Donors62
H-Bond Acceptors139
Rotatable Bonds66
Heavy Atoms514
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5007319.87
LogP ≤ 514.42
H-Bond Donors ≤ 562
H-Bond Acceptors ≤ 10139

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-[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-[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-[2-[4-(2-methoxyethoxymethoxy)phenyl]acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-[4-(2-methoxyethoxymethoxy)phenyl]propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[6-(4-methyl-2-oxopentyl)pyridine-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-[2-(propan-2-ylcarbamoylamino)pyridine-4-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-prop-2-enoxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;bis(4-[2-[(3,5-diamino-6-chloropyrazine-2-carbonyl)amino]-1,3,8-triazaspiro[4.5]dec-2-ene-8-carbonyl]-N-propan-2-ylindole-1-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 with MolForge

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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-[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-[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-[2-[4-(2-methoxyethoxymethoxy)phenyl]acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-[4-(2-methoxyethoxymethoxy)phenyl]propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[6-(4-methyl-2-oxopentyl)pyridine-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-[2-(propan-2-ylcarbamoylamino)pyridine-4-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-prop-2-enoxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;bis(4-[2-[(3,5-diamino-6-chloropyrazine-2-carbonyl)amino]-1,3,8-triazaspiro[4.5]dec-2-ene-8-carbonyl]-N-propan-2-ylindole-1-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?
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-[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-[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-[2-[4-(2-methoxyethoxymethoxy)phenyl]acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-[4-(2-methoxyethoxymethoxy)phenyl]propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[6-(4-methyl-2-oxopentyl)pyridine-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-[2-(propan-2-ylcarbamoylamino)pyridine-4-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-prop-2-enoxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;bis(4-[2-[(3,5-diamino-6-chloropyrazine-2-carbonyl)amino]-1,3,8-triazaspiro[4.5]dec-2-ene-8-carbonyl]-N-propan-2-ylindole-1-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 (CID 159393783) 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-[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-[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-[2-[4-(2-methoxyethoxymethoxy)phenyl]acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-[4-(2-methoxyethoxymethoxy)phenyl]propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[6-(4-methyl-2-oxopentyl)pyridine-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-[2-(propan-2-ylcarbamoylamino)pyridine-4-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-prop-2-enoxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;bis(4-[2-[(3,5-diamino-6-chloropyrazine-2-carbonyl)amino]-1,3,8-triazaspiro[4.5]dec-2-ene-8-carbonyl]-N-propan-2-ylindole-1-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.
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-[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-[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-[2-[4-(2-methoxyethoxymethoxy)phenyl]acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-[4-(2-methoxyethoxymethoxy)phenyl]propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[6-(4-methyl-2-oxopentyl)pyridine-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-[2-(propan-2-ylcarbamoylamino)pyridine-4-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-prop-2-enoxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;bis(4-[2-[(3,5-diamino-6-chloropyrazine-2-carbonyl)amino]-1,3,8-triazaspiro[4.5]dec-2-ene-8-carbonyl]-N-propan-2-ylindole-1-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?
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-[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-[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-[2-[4-(2-methoxyethoxymethoxy)phenyl]acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-[4-(2-methoxyethoxymethoxy)phenyl]propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[6-(4-methyl-2-oxopentyl)pyridine-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-[2-(propan-2-ylcarbamoylamino)pyridine-4-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-prop-2-enoxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;bis(4-[2-[(3,5-diamino-6-chloropyrazine-2-carbonyl)amino]-1,3,8-triazaspiro[4.5]dec-2-ene-8-carbonyl]-N-propan-2-ylindole-1-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 is C=CCOc1ccc(CCC(=O)N2CCC3(CC2)CN=C(NC(=O)c2nc(Cl)c(N)nc2N)N3)cc1.CC(C)CC(=O)Cc1ccc(C(=O)N2CCC3(CC2)CN=C(NC(=O)c2nc(Cl)c(N)nc2N)N3)cn1.CC(C)NC(=O)Nc1cc(C(=O)N2CCC3(CC2)CN=C(NC(=O)c2nc(Cl)c(N)nc2N)N3)ccn1.CC(C)NC(=O)n1ccc2c(C(=O)N3CCC4(CC3)CN=C(NC(=O)c3nc(Cl)c(N)nc3N)N4)cccc21.CC(C)NC(=O)n1ccc2c(C(=O)N3CCC4(CC3)CN=C(NC(=O)c3nc(Cl)c(N)nc3N)N4)cccc21.COCCOCOc1ccc(CC(=O)N2CCC3(CC2)CN=C(NC(=O)c2nc(Cl)c(N)nc2N)N3)cc1.COCCOCOc1ccc(CCC(=O)N2CCC3(CC2)CN=C(NC(=O)c2nc(Cl)c(N)nc2N)N3)cc1.COc1cc(OC)nc(COc2ccc(C(=O)N3CCC4(CC3)CN=C(NC(=O)c3nc(Cl)c(N)nc3N)N4)cc2)n1.Cc1nc(-c2ccccc2)ncc1C(=O)N1CCC2(CC1)CN=C(NC(=O)c1nc(Cl)c(N)nc1N)N2.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)c4cc5ccccc5[nH]4)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)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-[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-[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-[2-[4-(2-methoxyethoxymethoxy)phenyl]acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-[4-(2-methoxyethoxymethoxy)phenyl]propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[6-(4-methyl-2-oxopentyl)pyridine-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-[2-(propan-2-ylcarbamoylamino)pyridine-4-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-prop-2-enoxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;bis(4-[2-[(3,5-diamino-6-chloropyrazine-2-carbonyl)amino]-1,3,8-triazaspiro[4.5]dec-2-ene-8-carbonyl]-N-propan-2-ylindole-1-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?
The InChIKey is LMLLREWPUHPVRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H29ClN10O5.2C25H29ClN10O3.C25H33ClN8O5.C24H25ClN10O2.2C24H30ClN9O3.C24H31ClN8O5.C24H29ClN8O3.C22H28ClN11O3.C22H22ClN9O2.2C21H22ClN9O2.C21H25ClN8O3/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;2*1-13(2)30-24(39)36-9-6-14-15(4-3-5-16(14)36)22(38)35-10-7-25(8-11-35)12-29-23(34-25)33-21(37)17-19(27)32-20(28)18(26)31-17;1-37-12-13-38-15-39-17-5-2-16(3-6-17)4-7-18(35)34-10-8-25(9-11-34)14-29-24(33-25)32-23(36)19-21(27)31-22(28)20(26)30-19;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;1-13(2)9-16(35)10-15-4-3-14(11-28-15)22(37)34-7-5-24(6-8-34)12-29-23(33-24)32-21(36)17-19(26)31-20(27)18(25)30-17;1-36-10-11-37-14-38-16-4-2-15(3-5-16)12-17(34)33-8-6-24(7-9-33)13-28-23(32-24)31-22(35)18-20(26)30-21(27)19(25)29-18;1-2-13-36-16-6-3-15(4-7-16)5-8-17(34)33-11-9-24(10-12-33)14-28-23(32-24)31-22(35)18-20(26)30-21(27)19(25)29-18;1-11(2)28-21(37)29-13-9-12(3-6-26-13)19(36)34-7-4-22(5-8-34)10-27-20(33-22)32-18(35)14-16(24)31-17(25)15(23)30-14;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;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/h3-6,11H,7-10,12-13H2,1-2H3,(H4,28,29,34)(H2,30,35,36,38);2*3-6,9,13H,7-8,10-12H2,1-2H3,(H,30,39)(H4,27,28,32)(H2,29,33,34,37);2-3,5-6H,4,7-15H2,1H3,(H4,27,28,31)(H2,29,32,33,36);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);3-4,11,13H,5-10,12H2,1-2H3,(H4,26,27,31)(H2,29,32,33,36);2-5H,6-14H2,1H3,(H4,26,27,30)(H2,28,31,32,35);2-4,6-7H,1,5,8-14H2,(H4,26,27,30)(H2,28,31,32,35);3,6,9,11H,4-5,7-8,10H2,1-2H3,(H4,24,25,31)(H2,26,28,29,37)(H2,27,32,33,35);1-5,8H,6-7,9-11H2,(H4,24,25,29)(H2,27,30,31,33);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).
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-[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-[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-[2-[4-(2-methoxyethoxymethoxy)phenyl]acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-[4-(2-methoxyethoxymethoxy)phenyl]propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[6-(4-methyl-2-oxopentyl)pyridine-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-[2-(propan-2-ylcarbamoylamino)pyridine-4-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-prop-2-enoxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;bis(4-[2-[(3,5-diamino-6-chloropyrazine-2-carbonyl)amino]-1,3,8-triazaspiro[4.5]dec-2-ene-8-carbonyl]-N-propan-2-ylindole-1-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-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-[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-[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-[2-[4-(2-methoxyethoxymethoxy)phenyl]acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-[4-(2-methoxyethoxymethoxy)phenyl]propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[6-(4-methyl-2-oxopentyl)pyridine-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-[2-(propan-2-ylcarbamoylamino)pyridine-4-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-prop-2-enoxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;bis(4-[2-[(3,5-diamino-6-chloropyrazine-2-carbonyl)amino]-1,3,8-triazaspiro[4.5]dec-2-ene-8-carbonyl]-N-propan-2-ylindole-1-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 has a molecular weight of 7319.87 g/mol, XLogP of 14.42, 66 rotatable bonds, 62 hydrogen bond donors, and 139 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-[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-[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-[2-[4-(2-methoxyethoxymethoxy)phenyl]acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-[4-(2-methoxyethoxymethoxy)phenyl]propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[6-(4-methyl-2-oxopentyl)pyridine-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-[2-(propan-2-ylcarbamoylamino)pyridine-4-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-(4-prop-2-enoxyphenyl)propanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;bis(4-[2-[(3,5-diamino-6-chloropyrazine-2-carbonyl)amino]-1,3,8-triazaspiro[4.5]dec-2-ene-8-carbonyl]-N-propan-2-ylindole-1-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 is sourced from PubChem (CID 159393783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).