3,5-diamino-N-[8-(1-benzylimidazole-4-carbonyl)-1,8-diazaspiro[4.5]dec-1-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-N-[8-[2-(3-tert-butyl-1,2-oxazol-5-yl)acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-chloro-5-methoxy-4-[2-(4-methylpiperazin-1-yl)ethoxy]benzoyl]-2,8-diazaspiro[4.5]dec-2-en-3-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[1-[(4-chlorophenyl)methyl]-5-oxopyrrolidine-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[5-(dimethylsulfamoyl)-2-methylfuran-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[2-(1,1-dioxo-1,4-thiazinan-4-yl)-3-methylbutanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1-ethyl-7-methyl-4-oxo-1,8-naphthyridine-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(3-imidazol-1-ylpropanoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-methyl-2-pyridin-3-yl-1,3-thiazole-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(2-pyrazol-1-ylacetyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(3-pyridin-3-ylpropanoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[6-(2,2,2-trifluoroethoxy)pyridine-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide

C259H315Cl14F3N112O35S3 — CID 158370543

IUPAC3,5-diamino-N-[8-(1-benzylimidazole-4-carbonyl)-1,8-diazaspiro[4.5]dec-1-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-N-[8-[2-(3-tert-butyl-1,2-oxazol-5-yl)acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-chloro-5-methoxy-4-[2-(4-methylpiperazin-1-yl)ethoxy]benzoyl]-2,8-diazaspiro[4.5]dec-2-en-3-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[1-[(4-chlorophenyl)methyl]-5-oxopyrrolidine-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[5-(dimethylsulfamoyl)-2-methylfuran-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[2-(1,1-dioxo-1,4-thiazinan-4-yl)-3-methylbutanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1-ethyl-7-methyl-4-oxo-1,8-naphthyridine-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(3-imidazol-1-ylpropanoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-methyl-2-pyridin-3-yl-1,3-thiazole-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(2-pyrazol-1-ylacetyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(3-pyridin-3-ylpropanoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[6-(2,2,2-trifluoroethoxy)pyridine-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide
SMILESCC(C)(C)c1cc(CC(=O)N2CCC3(CC2)CN=C(NC(=O)c2nc(Cl)c(N)nc2N)N3)on1.CC(C)C(C(=O)N1CCC2(CC1)CN=C(NC(=O)c1nc(Cl)c(N)nc1N)N2)N1CCS(=O)(=O)CC1.CCn1cc(C(=O)N2CCC3(CC2)CN=C(NC(=O)c2nc(Cl)c(N)nc2N)N3)c(=O)c2ccc(C)nc21.COc1cc(C(=O)N2CCC3(CC2)CN=C(NC(=O)c2nc(Cl)c(N)nc2N)C3)cc(Cl)c1OCCN1CCN(C)CC1.Cc1nc(-c2cccnc2)sc1C(=O)N1CCC2(CC1)CN=C(NC(=O)c1nc(Cl)c(N)nc1N)N2.Cc1oc(S(=O)(=O)N(C)C)cc1C(=O)N1CCC2(CC1)CN=C(NC(=O)c1nc(Cl)c(N)nc1N)N2.Nc1nc(N)c(C(=O)NC2=NC3(CC2)CCN(C(=O)c2cn(Cc4ccccc4)cn2)CC3)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)C4CC(=O)N(Cc5ccc(Cl)cc5)C4)CC3)N2)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)CCc4cccnc4)CC3)N2)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)CCn4ccnc4)CC3)N2)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)Cn4cccn4)CC3)N2)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)c4ccc(OCC(F)(F)F)nc4)CC3)N2)nc1Cl
InChIInChI=1S/C28H37Cl2N9O4.C24H27Cl2N9O3.C24H27ClN10O3.C24H26ClN9O2.C22H23ClN10O2S.C21H32ClN9O4S.C21H28ClN9O3.C20H21ClF3N9O3.C20H26ClN9O5S.C20H24ClN9O2.C18H23ClN10O2.C17H21ClN10O2/c1-37-7-9-38(10-8-37)11-12-43-22-18(29)13-17(14-19(22)42-2)27(41)39-5-3-28(4-6-39)15-20(33-16-28)34-26(40)21-24(31)36-25(32)23(30)35-21;25-15-3-1-13(2-4-15)10-35-11-14(9-16(35)36)22(38)34-7-5-24(6-8-34)12-29-23(33-24)32-21(37)17-19(27)31-20(28)18(26)30-17;1-3-34-10-14(16(36)13-5-4-12(2)29-20(13)34)22(38)35-8-6-24(7-9-35)11-28-23(33-24)32-21(37)15-18(26)31-19(27)17(25)30-15;25-19-21(27)31-20(26)18(30-19)22(35)29-17-6-7-24(32-17)8-10-34(11-9-24)23(36)16-13-33(14-28-16)12-15-4-2-1-3-5-15;1-11-14(36-19(28-11)12-3-2-6-26-9-12)20(35)33-7-4-22(5-8-33)10-27-21(32-22)31-18(34)13-16(24)30-17(25)15(23)29-13;1-12(2)14(30-7-9-36(34,35)10-8-30)19(33)31-5-3-21(4-6-31)11-25-20(29-21)28-18(32)13-16(23)27-17(24)15(22)26-13;1-20(2,3)12-8-11(34-30-12)9-13(32)31-6-4-21(5-7-31)10-25-19(29-21)28-18(33)14-16(23)27-17(24)15(22)26-14;21-13-15(26)30-14(25)12(29-13)16(34)31-18-28-8-19(32-18)3-5-33(6-4-19)17(35)10-1-2-11(27-7-10)36-9-20(22,23)24;1-10-11(8-12(35-10)36(33,34)29(2)3)18(32)30-6-4-20(5-7-30)9-24-19(28-20)27-17(31)13-15(22)26-16(23)14(21)25-13;21-15-17(23)27-16(22)14(26-15)18(32)28-19-25-11-20(29-19)5-8-30(9-6-20)13(31)4-3-12-2-1-7-24-10-12;19-13-15(21)25-14(20)12(24-13)16(31)26-17-23-9-18(27-17)2-6-29(7-3-18)11(30)1-5-28-8-4-22-10-28;18-12-14(20)24-13(19)11(23-12)15(30)25-16-21-9-17(26-16)2-6-27(7-3-17)10(29)8-28-5-1-4-22-28/h13-14H,3-12,15-16H2,1-2H3,(H4,31,32,36)(H,33,34,40);1-4,14H,5-12H2,(H4,27,28,31)(H2,29,32,33,37);4-5,10H,3,6-9,11H2,1-2H3,(H4,26,27,31)(H2,28,32,33,37);1-5,13-14H,6-12H2,(H4,26,27,31)(H,29,32,35);2-3,6,9H,4-5,7-8,10H2,1H3,(H4,24,25,30)(H2,27,31,32,34);12,14H,3-11H2,1-2H3,(H4,23,24,27)(H2,25,28,29,32);8H,4-7,9-10H2,1-3H3,(H4,23,24,27)(H2,25,28,29,33);1-2,7H,3-6,8-9H2,(H4,25,26,30)(H2,28,31,32,34);8H,4-7,9H2,1-3H3,(H4,22,23,26)(H2,24,27,28,31);1-2,7,10H,3-6,8-9,11H2,(H4,22,23,27)(H2,25,28,29,32);4,8,10H,1-3,5-7,9H2,(H4,20,21,25)(H2,23,26,27,31);1,4-5H,2-3,6-9H2,(H4,19,20,24)(H2,21,25,26,30)
InChIKeyGUOBPDXKHPGCRX-UHFFFAOYSA-N
MW6206.66 g/mol
LogP7.42
Rot. Bonds47

About 3,5-diamino-N-[8-(1-benzylimidazole-4-carbonyl)-1,8-diazaspiro[4.5]dec-1-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-N-[8-[2-(3-tert-butyl-1,2-oxazol-5-yl)acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-chloro-5-methoxy-4-[2-(4-methylpiperazin-1-yl)ethoxy]benzoyl]-2,8-diazaspiro[4.5]dec-2-en-3-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[1-[(4-chlorophenyl)methyl]-5-oxopyrrolidine-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[5-(dimethylsulfamoyl)-2-methylfuran-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[2-(1,1-dioxo-1,4-thiazinan-4-yl)-3-methylbutanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1-ethyl-7-methyl-4-oxo-1,8-naphthyridine-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(3-imidazol-1-ylpropanoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-methyl-2-pyridin-3-yl-1,3-thiazole-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(2-pyrazol-1-ylacetyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(3-pyridin-3-ylpropanoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[6-(2,2,2-trifluoroethoxy)pyridine-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide

3,5-diamino-N-[8-(1-benzylimidazole-4-carbonyl)-1,8-diazaspiro[4.5]dec-1-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-N-[8-[2-(3-tert-butyl-1,2-oxazol-5-yl)acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-chloro-5-methoxy-4-[2-(4-methylpiperazin-1-yl)ethoxy]benzoyl]-2,8-diazaspiro[4.5]dec-2-en-3-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[1-[(4-chlorophenyl)methyl]-5-oxopyrrolidine-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[5-(dimethylsulfamoyl)-2-methylfuran-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[2-(1,1-dioxo-1,4-thiazinan-4-yl)-3-methylbutanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1-ethyl-7-methyl-4-oxo-1,8-naphthyridine-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(3-imidazol-1-ylpropanoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-methyl-2-pyridin-3-yl-1,3-thiazole-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(2-pyrazol-1-ylacetyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(3-pyridin-3-ylpropanoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[6-(2,2,2-trifluoroethoxy)pyridine-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide (PubChem CID 158370543) has the molecular formula C259H315Cl14F3N112O35S3 and a molecular weight of 6206.66 g/mol. Its IUPAC name is 3,5-diamino-N-[8-(1-benzylimidazole-4-carbonyl)-1,8-diazaspiro[4.5]dec-1-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-N-[8-[2-(3-tert-butyl-1,2-oxazol-5-yl)acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-chloro-5-methoxy-4-[2-(4-methylpiperazin-1-yl)ethoxy]benzoyl]-2,8-diazaspiro[4.5]dec-2-en-3-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[1-[(4-chlorophenyl)methyl]-5-oxopyrrolidine-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[5-(dimethylsulfamoyl)-2-methylfuran-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[2-(1,1-dioxo-1,4-thiazinan-4-yl)-3-methylbutanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1-ethyl-7-methyl-4-oxo-1,8-naphthyridine-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(3-imidazol-1-ylpropanoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-methyl-2-pyridin-3-yl-1,3-thiazole-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(2-pyrazol-1-ylacetyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(3-pyridin-3-ylpropanoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[6-(2,2,2-trifluoroethoxy)pyridine-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide.

Molecular Properties

Compound Name3,5-diamino-N-[8-(1-benzylimidazole-4-carbonyl)-1,8-diazaspiro[4.5]dec-1-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-N-[8-[2-(3-tert-butyl-1,2-oxazol-5-yl)acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-chloro-5-methoxy-4-[2-(4-methylpiperazin-1-yl)ethoxy]benzoyl]-2,8-diazaspiro[4.5]dec-2-en-3-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[1-[(4-chlorophenyl)methyl]-5-oxopyrrolidine-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[5-(dimethylsulfamoyl)-2-methylfuran-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[2-(1,1-dioxo-1,4-thiazinan-4-yl)-3-methylbutanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1-ethyl-7-methyl-4-oxo-1,8-naphthyridine-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(3-imidazol-1-ylpropanoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-methyl-2-pyridin-3-yl-1,3-thiazole-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(2-pyrazol-1-ylacetyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(3-pyridin-3-ylpropanoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[6-(2,2,2-trifluoroethoxy)pyridine-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide
PubChem CID158370543
Molecular FormulaC259H315Cl14F3N112O35S3
Molecular Weight6206.66 g/mol
Exact Mass6196.11
IUPAC Name3,5-diamino-N-[8-(1-benzylimidazole-4-carbonyl)-1,8-diazaspiro[4.5]dec-1-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-N-[8-[2-(3-tert-butyl-1,2-oxazol-5-yl)acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-chloro-5-methoxy-4-[2-(4-methylpiperazin-1-yl)ethoxy]benzoyl]-2,8-diazaspiro[4.5]dec-2-en-3-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[1-[(4-chlorophenyl)methyl]-5-oxopyrrolidine-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[5-(dimethylsulfamoyl)-2-methylfuran-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[2-(1,1-dioxo-1,4-thiazinan-4-yl)-3-methylbutanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1-ethyl-7-methyl-4-oxo-1,8-naphthyridine-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(3-imidazol-1-ylpropanoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-methyl-2-pyridin-3-yl-1,3-thiazole-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(2-pyrazol-1-ylacetyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(3-pyridin-3-ylpropanoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[6-(2,2,2-trifluoroethoxy)pyridine-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide
SMILESCC(C)(C)c1cc(CC(=O)N2CCC3(CC2)CN=C(NC(=O)c2nc(Cl)c(N)nc2N)N3)on1.CC(C)C(C(=O)N1CCC2(CC1)CN=C(NC(=O)c1nc(Cl)c(N)nc1N)N2)N1CCS(=O)(=O)CC1.CCn1cc(C(=O)N2CCC3(CC2)CN=C(NC(=O)c2nc(Cl)c(N)nc2N)N3)c(=O)c2ccc(C)nc21.COc1cc(C(=O)N2CCC3(CC2)CN=C(NC(=O)c2nc(Cl)c(N)nc2N)C3)cc(Cl)c1OCCN1CCN(C)CC1.Cc1nc(-c2cccnc2)sc1C(=O)N1CCC2(CC1)CN=C(NC(=O)c1nc(Cl)c(N)nc1N)N2.Cc1oc(S(=O)(=O)N(C)C)cc1C(=O)N1CCC2(CC1)CN=C(NC(=O)c1nc(Cl)c(N)nc1N)N2.Nc1nc(N)c(C(=O)NC2=NC3(CC2)CCN(C(=O)c2cn(Cc4ccccc4)cn2)CC3)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)C4CC(=O)N(Cc5ccc(Cl)cc5)C4)CC3)N2)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)CCc4cccnc4)CC3)N2)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)CCn4ccnc4)CC3)N2)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)Cn4cccn4)CC3)N2)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)c4ccc(OCC(F)(F)F)nc4)CC3)N2)nc1Cl
InChIInChI=1S/C28H37Cl2N9O4.C24H27Cl2N9O3.C24H27ClN10O3.C24H26ClN9O2.C22H23ClN10O2S.C21H32ClN9O4S.C21H28ClN9O3.C20H21ClF3N9O3.C20H26ClN9O5S.C20H24ClN9O2.C18H23ClN10O2.C17H21ClN10O2/c1-37-7-9-38(10-8-37)11-12-43-22-18(29)13-17(14-19(22)42-2)27(41)39-5-3-28(4-6-39)15-20(33-16-28)34-26(40)21-24(31)36-25(32)23(30)35-21;25-15-3-1-13(2-4-15)10-35-11-14(9-16(35)36)22(38)34-7-5-24(6-8-34)12-29-23(33-24)32-21(37)17-19(27)31-20(28)18(26)30-17;1-3-34-10-14(16(36)13-5-4-12(2)29-20(13)34)22(38)35-8-6-24(7-9-35)11-28-23(33-24)32-21(37)15-18(26)31-19(27)17(25)30-15;25-19-21(27)31-20(26)18(30-19)22(35)29-17-6-7-24(32-17)8-10-34(11-9-24)23(36)16-13-33(14-28-16)12-15-4-2-1-3-5-15;1-11-14(36-19(28-11)12-3-2-6-26-9-12)20(35)33-7-4-22(5-8-33)10-27-21(32-22)31-18(34)13-16(24)30-17(25)15(23)29-13;1-12(2)14(30-7-9-36(34,35)10-8-30)19(33)31-5-3-21(4-6-31)11-25-20(29-21)28-18(32)13-16(23)27-17(24)15(22)26-13;1-20(2,3)12-8-11(34-30-12)9-13(32)31-6-4-21(5-7-31)10-25-19(29-21)28-18(33)14-16(23)27-17(24)15(22)26-14;21-13-15(26)30-14(25)12(29-13)16(34)31-18-28-8-19(32-18)3-5-33(6-4-19)17(35)10-1-2-11(27-7-10)36-9-20(22,23)24;1-10-11(8-12(35-10)36(33,34)29(2)3)18(32)30-6-4-20(5-7-30)9-24-19(28-20)27-17(31)13-15(22)26-16(23)14(21)25-13;21-15-17(23)27-16(22)14(26-15)18(32)28-19-25-11-20(29-19)5-8-30(9-6-20)13(31)4-3-12-2-1-7-24-10-12;19-13-15(21)25-14(20)12(24-13)16(31)26-17-23-9-18(27-17)2-6-29(7-3-18)11(30)1-5-28-8-4-22-10-28;18-12-14(20)24-13(19)11(23-12)15(30)25-16-21-9-17(26-16)2-6-27(7-3-17)10(29)8-28-5-1-4-22-28/h13-14H,3-12,15-16H2,1-2H3,(H4,31,32,36)(H,33,34,40);1-4,14H,5-12H2,(H4,27,28,31)(H2,29,32,33,37);4-5,10H,3,6-9,11H2,1-2H3,(H4,26,27,31)(H2,28,32,33,37);1-5,13-14H,6-12H2,(H4,26,27,31)(H,29,32,35);2-3,6,9H,4-5,7-8,10H2,1H3,(H4,24,25,30)(H2,27,31,32,34);12,14H,3-11H2,1-2H3,(H4,23,24,27)(H2,25,28,29,32);8H,4-7,9-10H2,1-3H3,(H4,23,24,27)(H2,25,28,29,33);1-2,7H,3-6,8-9H2,(H4,25,26,30)(H2,28,31,32,34);8H,4-7,9H2,1-3H3,(H4,22,23,26)(H2,24,27,28,31);1-2,7,10H,3-6,8-9,11H2,(H4,22,23,27)(H2,25,28,29,32);4,8,10H,1-3,5-7,9H2,(H4,20,21,25)(H2,23,26,27,31);1,4-5H,2-3,6-9H2,(H4,19,20,24)(H2,21,25,26,30)
InChIKeyGUOBPDXKHPGCRX-UHFFFAOYSA-N
XLogP7.42
TPSA2103.70 Ų
H-Bond Donors46
H-Bond Acceptors122
Rotatable Bonds47
Heavy Atoms426
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5006206.66
LogP ≤ 57.42
H-Bond Donors ≤ 546
H-Bond Acceptors ≤ 10122

Analyze 3,5-diamino-N-[8-(1-benzylimidazole-4-carbonyl)-1,8-diazaspiro[4.5]dec-1-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-N-[8-[2-(3-tert-butyl-1,2-oxazol-5-yl)acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-chloro-5-methoxy-4-[2-(4-methylpiperazin-1-yl)ethoxy]benzoyl]-2,8-diazaspiro[4.5]dec-2-en-3-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[1-[(4-chlorophenyl)methyl]-5-oxopyrrolidine-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[5-(dimethylsulfamoyl)-2-methylfuran-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[2-(1,1-dioxo-1,4-thiazinan-4-yl)-3-methylbutanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1-ethyl-7-methyl-4-oxo-1,8-naphthyridine-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(3-imidazol-1-ylpropanoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-methyl-2-pyridin-3-yl-1,3-thiazole-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(2-pyrazol-1-ylacetyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(3-pyridin-3-ylpropanoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[6-(2,2,2-trifluoroethoxy)pyridine-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3,5-diamino-N-[8-(1-benzylimidazole-4-carbonyl)-1,8-diazaspiro[4.5]dec-1-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-N-[8-[2-(3-tert-butyl-1,2-oxazol-5-yl)acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-chloro-5-methoxy-4-[2-(4-methylpiperazin-1-yl)ethoxy]benzoyl]-2,8-diazaspiro[4.5]dec-2-en-3-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[1-[(4-chlorophenyl)methyl]-5-oxopyrrolidine-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[5-(dimethylsulfamoyl)-2-methylfuran-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[2-(1,1-dioxo-1,4-thiazinan-4-yl)-3-methylbutanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1-ethyl-7-methyl-4-oxo-1,8-naphthyridine-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(3-imidazol-1-ylpropanoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-methyl-2-pyridin-3-yl-1,3-thiazole-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(2-pyrazol-1-ylacetyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(3-pyridin-3-ylpropanoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[6-(2,2,2-trifluoroethoxy)pyridine-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide?
The IUPAC name of 3,5-diamino-N-[8-(1-benzylimidazole-4-carbonyl)-1,8-diazaspiro[4.5]dec-1-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-N-[8-[2-(3-tert-butyl-1,2-oxazol-5-yl)acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-chloro-5-methoxy-4-[2-(4-methylpiperazin-1-yl)ethoxy]benzoyl]-2,8-diazaspiro[4.5]dec-2-en-3-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[1-[(4-chlorophenyl)methyl]-5-oxopyrrolidine-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[5-(dimethylsulfamoyl)-2-methylfuran-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[2-(1,1-dioxo-1,4-thiazinan-4-yl)-3-methylbutanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1-ethyl-7-methyl-4-oxo-1,8-naphthyridine-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(3-imidazol-1-ylpropanoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-methyl-2-pyridin-3-yl-1,3-thiazole-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(2-pyrazol-1-ylacetyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(3-pyridin-3-ylpropanoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[6-(2,2,2-trifluoroethoxy)pyridine-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide (CID 158370543) is 3,5-diamino-N-[8-(1-benzylimidazole-4-carbonyl)-1,8-diazaspiro[4.5]dec-1-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-N-[8-[2-(3-tert-butyl-1,2-oxazol-5-yl)acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-chloro-5-methoxy-4-[2-(4-methylpiperazin-1-yl)ethoxy]benzoyl]-2,8-diazaspiro[4.5]dec-2-en-3-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[1-[(4-chlorophenyl)methyl]-5-oxopyrrolidine-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[5-(dimethylsulfamoyl)-2-methylfuran-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[2-(1,1-dioxo-1,4-thiazinan-4-yl)-3-methylbutanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1-ethyl-7-methyl-4-oxo-1,8-naphthyridine-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(3-imidazol-1-ylpropanoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-methyl-2-pyridin-3-yl-1,3-thiazole-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(2-pyrazol-1-ylacetyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(3-pyridin-3-ylpropanoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[6-(2,2,2-trifluoroethoxy)pyridine-3-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-(1-benzylimidazole-4-carbonyl)-1,8-diazaspiro[4.5]dec-1-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-N-[8-[2-(3-tert-butyl-1,2-oxazol-5-yl)acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-chloro-5-methoxy-4-[2-(4-methylpiperazin-1-yl)ethoxy]benzoyl]-2,8-diazaspiro[4.5]dec-2-en-3-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[1-[(4-chlorophenyl)methyl]-5-oxopyrrolidine-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[5-(dimethylsulfamoyl)-2-methylfuran-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[2-(1,1-dioxo-1,4-thiazinan-4-yl)-3-methylbutanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1-ethyl-7-methyl-4-oxo-1,8-naphthyridine-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(3-imidazol-1-ylpropanoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-methyl-2-pyridin-3-yl-1,3-thiazole-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(2-pyrazol-1-ylacetyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(3-pyridin-3-ylpropanoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[6-(2,2,2-trifluoroethoxy)pyridine-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide?
The canonical SMILES for 3,5-diamino-N-[8-(1-benzylimidazole-4-carbonyl)-1,8-diazaspiro[4.5]dec-1-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-N-[8-[2-(3-tert-butyl-1,2-oxazol-5-yl)acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-chloro-5-methoxy-4-[2-(4-methylpiperazin-1-yl)ethoxy]benzoyl]-2,8-diazaspiro[4.5]dec-2-en-3-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[1-[(4-chlorophenyl)methyl]-5-oxopyrrolidine-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[5-(dimethylsulfamoyl)-2-methylfuran-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[2-(1,1-dioxo-1,4-thiazinan-4-yl)-3-methylbutanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1-ethyl-7-methyl-4-oxo-1,8-naphthyridine-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(3-imidazol-1-ylpropanoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-methyl-2-pyridin-3-yl-1,3-thiazole-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(2-pyrazol-1-ylacetyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(3-pyridin-3-ylpropanoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[6-(2,2,2-trifluoroethoxy)pyridine-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide is CC(C)(C)c1cc(CC(=O)N2CCC3(CC2)CN=C(NC(=O)c2nc(Cl)c(N)nc2N)N3)on1.CC(C)C(C(=O)N1CCC2(CC1)CN=C(NC(=O)c1nc(Cl)c(N)nc1N)N2)N1CCS(=O)(=O)CC1.CCn1cc(C(=O)N2CCC3(CC2)CN=C(NC(=O)c2nc(Cl)c(N)nc2N)N3)c(=O)c2ccc(C)nc21.COc1cc(C(=O)N2CCC3(CC2)CN=C(NC(=O)c2nc(Cl)c(N)nc2N)C3)cc(Cl)c1OCCN1CCN(C)CC1.Cc1nc(-c2cccnc2)sc1C(=O)N1CCC2(CC1)CN=C(NC(=O)c1nc(Cl)c(N)nc1N)N2.Cc1oc(S(=O)(=O)N(C)C)cc1C(=O)N1CCC2(CC1)CN=C(NC(=O)c1nc(Cl)c(N)nc1N)N2.Nc1nc(N)c(C(=O)NC2=NC3(CC2)CCN(C(=O)c2cn(Cc4ccccc4)cn2)CC3)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)C4CC(=O)N(Cc5ccc(Cl)cc5)C4)CC3)N2)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)CCc4cccnc4)CC3)N2)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)CCn4ccnc4)CC3)N2)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)Cn4cccn4)CC3)N2)nc1Cl.Nc1nc(N)c(C(=O)NC2=NCC3(CCN(C(=O)c4ccc(OCC(F)(F)F)nc4)CC3)N2)nc1Cl.
What is the InChIKey of 3,5-diamino-N-[8-(1-benzylimidazole-4-carbonyl)-1,8-diazaspiro[4.5]dec-1-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-N-[8-[2-(3-tert-butyl-1,2-oxazol-5-yl)acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-chloro-5-methoxy-4-[2-(4-methylpiperazin-1-yl)ethoxy]benzoyl]-2,8-diazaspiro[4.5]dec-2-en-3-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[1-[(4-chlorophenyl)methyl]-5-oxopyrrolidine-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[5-(dimethylsulfamoyl)-2-methylfuran-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[2-(1,1-dioxo-1,4-thiazinan-4-yl)-3-methylbutanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1-ethyl-7-methyl-4-oxo-1,8-naphthyridine-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(3-imidazol-1-ylpropanoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-methyl-2-pyridin-3-yl-1,3-thiazole-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(2-pyrazol-1-ylacetyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(3-pyridin-3-ylpropanoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[6-(2,2,2-trifluoroethoxy)pyridine-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide?
The InChIKey is GUOBPDXKHPGCRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H37Cl2N9O4.C24H27Cl2N9O3.C24H27ClN10O3.C24H26ClN9O2.C22H23ClN10O2S.C21H32ClN9O4S.C21H28ClN9O3.C20H21ClF3N9O3.C20H26ClN9O5S.C20H24ClN9O2.C18H23ClN10O2.C17H21ClN10O2/c1-37-7-9-38(10-8-37)11-12-43-22-18(29)13-17(14-19(22)42-2)27(41)39-5-3-28(4-6-39)15-20(33-16-28)34-26(40)21-24(31)36-25(32)23(30)35-21;25-15-3-1-13(2-4-15)10-35-11-14(9-16(35)36)22(38)34-7-5-24(6-8-34)12-29-23(33-24)32-21(37)17-19(27)31-20(28)18(26)30-17;1-3-34-10-14(16(36)13-5-4-12(2)29-20(13)34)22(38)35-8-6-24(7-9-35)11-28-23(33-24)32-21(37)15-18(26)31-19(27)17(25)30-15;25-19-21(27)31-20(26)18(30-19)22(35)29-17-6-7-24(32-17)8-10-34(11-9-24)23(36)16-13-33(14-28-16)12-15-4-2-1-3-5-15;1-11-14(36-19(28-11)12-3-2-6-26-9-12)20(35)33-7-4-22(5-8-33)10-27-21(32-22)31-18(34)13-16(24)30-17(25)15(23)29-13;1-12(2)14(30-7-9-36(34,35)10-8-30)19(33)31-5-3-21(4-6-31)11-25-20(29-21)28-18(32)13-16(23)27-17(24)15(22)26-13;1-20(2,3)12-8-11(34-30-12)9-13(32)31-6-4-21(5-7-31)10-25-19(29-21)28-18(33)14-16(23)27-17(24)15(22)26-14;21-13-15(26)30-14(25)12(29-13)16(34)31-18-28-8-19(32-18)3-5-33(6-4-19)17(35)10-1-2-11(27-7-10)36-9-20(22,23)24;1-10-11(8-12(35-10)36(33,34)29(2)3)18(32)30-6-4-20(5-7-30)9-24-19(28-20)27-17(31)13-15(22)26-16(23)14(21)25-13;21-15-17(23)27-16(22)14(26-15)18(32)28-19-25-11-20(29-19)5-8-30(9-6-20)13(31)4-3-12-2-1-7-24-10-12;19-13-15(21)25-14(20)12(24-13)16(31)26-17-23-9-18(27-17)2-6-29(7-3-18)11(30)1-5-28-8-4-22-10-28;18-12-14(20)24-13(19)11(23-12)15(30)25-16-21-9-17(26-16)2-6-27(7-3-17)10(29)8-28-5-1-4-22-28/h13-14H,3-12,15-16H2,1-2H3,(H4,31,32,36)(H,33,34,40);1-4,14H,5-12H2,(H4,27,28,31)(H2,29,32,33,37);4-5,10H,3,6-9,11H2,1-2H3,(H4,26,27,31)(H2,28,32,33,37);1-5,13-14H,6-12H2,(H4,26,27,31)(H,29,32,35);2-3,6,9H,4-5,7-8,10H2,1H3,(H4,24,25,30)(H2,27,31,32,34);12,14H,3-11H2,1-2H3,(H4,23,24,27)(H2,25,28,29,32);8H,4-7,9-10H2,1-3H3,(H4,23,24,27)(H2,25,28,29,33);1-2,7H,3-6,8-9H2,(H4,25,26,30)(H2,28,31,32,34);8H,4-7,9H2,1-3H3,(H4,22,23,26)(H2,24,27,28,31);1-2,7,10H,3-6,8-9,11H2,(H4,22,23,27)(H2,25,28,29,32);4,8,10H,1-3,5-7,9H2,(H4,20,21,25)(H2,23,26,27,31);1,4-5H,2-3,6-9H2,(H4,19,20,24)(H2,21,25,26,30).
What are the key properties of 3,5-diamino-N-[8-(1-benzylimidazole-4-carbonyl)-1,8-diazaspiro[4.5]dec-1-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-N-[8-[2-(3-tert-butyl-1,2-oxazol-5-yl)acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-chloro-5-methoxy-4-[2-(4-methylpiperazin-1-yl)ethoxy]benzoyl]-2,8-diazaspiro[4.5]dec-2-en-3-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[1-[(4-chlorophenyl)methyl]-5-oxopyrrolidine-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[5-(dimethylsulfamoyl)-2-methylfuran-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[2-(1,1-dioxo-1,4-thiazinan-4-yl)-3-methylbutanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1-ethyl-7-methyl-4-oxo-1,8-naphthyridine-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(3-imidazol-1-ylpropanoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-methyl-2-pyridin-3-yl-1,3-thiazole-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(2-pyrazol-1-ylacetyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(3-pyridin-3-ylpropanoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[6-(2,2,2-trifluoroethoxy)pyridine-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide?
3,5-diamino-N-[8-(1-benzylimidazole-4-carbonyl)-1,8-diazaspiro[4.5]dec-1-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-N-[8-[2-(3-tert-butyl-1,2-oxazol-5-yl)acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-chloro-5-methoxy-4-[2-(4-methylpiperazin-1-yl)ethoxy]benzoyl]-2,8-diazaspiro[4.5]dec-2-en-3-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[1-[(4-chlorophenyl)methyl]-5-oxopyrrolidine-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[5-(dimethylsulfamoyl)-2-methylfuran-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[2-(1,1-dioxo-1,4-thiazinan-4-yl)-3-methylbutanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1-ethyl-7-methyl-4-oxo-1,8-naphthyridine-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(3-imidazol-1-ylpropanoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-methyl-2-pyridin-3-yl-1,3-thiazole-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(2-pyrazol-1-ylacetyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(3-pyridin-3-ylpropanoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[6-(2,2,2-trifluoroethoxy)pyridine-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide has a molecular weight of 6206.66 g/mol, XLogP of 7.42, 47 rotatable bonds, 46 hydrogen bond donors, and 122 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-diamino-N-[8-(1-benzylimidazole-4-carbonyl)-1,8-diazaspiro[4.5]dec-1-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-N-[8-[2-(3-tert-butyl-1,2-oxazol-5-yl)acetyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]-6-chloropyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[3-chloro-5-methoxy-4-[2-(4-methylpiperazin-1-yl)ethoxy]benzoyl]-2,8-diazaspiro[4.5]dec-2-en-3-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[1-[(4-chlorophenyl)methyl]-5-oxopyrrolidine-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[5-(dimethylsulfamoyl)-2-methylfuran-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[2-(1,1-dioxo-1,4-thiazinan-4-yl)-3-methylbutanoyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(1-ethyl-7-methyl-4-oxo-1,8-naphthyridine-3-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(3-imidazol-1-ylpropanoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(4-methyl-2-pyridin-3-yl-1,3-thiazole-5-carbonyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(2-pyrazol-1-ylacetyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-(3-pyridin-3-ylpropanoyl)-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide;3,5-diamino-6-chloro-N-[8-[6-(2,2,2-trifluoroethoxy)pyridine-3-carbonyl]-1,3,8-triazaspiro[4.5]dec-2-en-2-yl]pyrazine-2-carboxamide is sourced from PubChem (CID 158370543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).