7-amino-4-(aminomethyl)-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;4-amino-3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;7-amino-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;4-(aminomethyl)-3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;4-(aminomethyl)-5-phenyl-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidin-7-amine;3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;3-bromo-5-phenyl-7-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidine-4,7-diamine;4,7-diamino-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;5-phenyl-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;5-phenyl-7-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidine-4,7-diamine

C175H135Br4Cl6N64+7 — CID 158012289

IUPAC7-amino-4-(aminomethyl)-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;4-amino-3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;7-amino-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;4-(aminomethyl)-3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;4-(aminomethyl)-5-phenyl-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidin-7-amine;3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;3-bromo-5-phenyl-7-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidine-4,7-diamine;4,7-diamino-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;5-phenyl-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;5-phenyl-7-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidine-4,7-diamine
SMILESN#C[n+]1c(-c2ccccc2Cl)c(CN)c2c(Br)cnn2c1NCc1cccnc1.N#C[n+]1c(-c2ccccc2Cl)c(CN)c2ccnn2c1N.N#C[n+]1c(-c2ccccc2Cl)c(N)c2c(Br)cnn2c1NCc1cccnc1.N#C[n+]1c(-c2ccccc2Cl)c(N)c2ccnn2c1N.N#Cc1c(-c2ccccc2)[n+](C#N)c(NCc2cccnc2)n2nccc12.N#Cc1c(-c2ccccc2Cl)[n+](C#N)c(N)n2nccc12.N#Cc1c(-c2ccccc2Cl)[n+](C#N)c(NCc2cccnc2)n2ncc(Br)c12.NCc1c(-c2ccccc2)nc(NCc2cccnc2)n2nccc12.Nc1c(-c2ccccc2)nc(NCc2cccnc2)n2ncc(Br)c12.Nc1c(-c2ccccc2)nc(NCc2cccnc2)n2nccc12
InChIInChI=1S/C20H15BrClN7.C20H11BrClN7.C20H13N7.C19H13BrClN7.C19H18N6.C18H15BrN6.C18H16N6.C14H11ClN6.C14H7ClN6.C13H9ClN6/c2*21-16-11-27-29-19(16)15(8-23)18(14-5-1-2-6-17(14)22)28(12-24)20(29)26-10-13-4-3-7-25-9-13;21-11-17-18-8-10-25-27(18)20(24-13-15-5-4-9-23-12-15)26(14-22)19(17)16-6-2-1-3-7-16;20-14-10-26-28-18(14)16(23)17(13-5-1-2-6-15(13)21)27(11-22)19(28)25-9-12-4-3-7-24-8-12;20-11-16-17-8-10-23-25(17)19(22-13-14-5-4-9-21-12-14)24-18(16)15-6-2-1-3-7-15;19-14-11-23-25-17(14)15(20)16(13-6-2-1-3-7-13)24-18(25)22-10-12-5-4-8-21-9-12;19-16-15-8-10-22-24(15)18(21-12-13-5-4-9-20-11-13)23-17(16)14-6-2-1-3-7-14;2*15-11-4-2-1-3-9(11)13-10(7-16)12-5-6-19-21(12)14(18)20(13)8-17;14-9-4-2-1-3-8(9)12-11(16)10-5-6-18-20(10)13(17)19(12)7-15/h1-7,9,11H,8,10,23H2;1-7,9,11H,10H2;1-10,12H,13H2;1-8,10H,9,23H2;1-10,12H,11,13,20H2,(H,22,24);1-9,11H,10,20H2,(H,22,24);1-11H,12,19H2,(H,21,23);1-6,18H,7,16H2;1-6,18H;1-6,17H,16H2/p+7
InChIKeyPPCIARUEYXOIEA-UHFFFAOYSA-U
MW3666.79 g/mol
LogP27.60
Rot. Bonds34

About 7-amino-4-(aminomethyl)-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;4-amino-3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;7-amino-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;4-(aminomethyl)-3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;4-(aminomethyl)-5-phenyl-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidin-7-amine;3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;3-bromo-5-phenyl-7-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidine-4,7-diamine;4,7-diamino-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;5-phenyl-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;5-phenyl-7-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidine-4,7-diamine

7-amino-4-(aminomethyl)-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;4-amino-3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;7-amino-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;4-(aminomethyl)-3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;4-(aminomethyl)-5-phenyl-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidin-7-amine;3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;3-bromo-5-phenyl-7-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidine-4,7-diamine;4,7-diamino-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;5-phenyl-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;5-phenyl-7-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidine-4,7-diamine (PubChem CID 158012289) has the molecular formula C175H135Br4Cl6N64+7 and a molecular weight of 3666.79 g/mol. Its IUPAC name is 7-amino-4-(aminomethyl)-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;4-amino-3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;7-amino-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;4-(aminomethyl)-3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;4-(aminomethyl)-5-phenyl-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidin-7-amine;3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;3-bromo-5-phenyl-7-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidine-4,7-diamine;4,7-diamino-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;5-phenyl-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;5-phenyl-7-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidine-4,7-diamine.

Molecular Properties

Compound Name7-amino-4-(aminomethyl)-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;4-amino-3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;7-amino-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;4-(aminomethyl)-3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;4-(aminomethyl)-5-phenyl-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidin-7-amine;3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;3-bromo-5-phenyl-7-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidine-4,7-diamine;4,7-diamino-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;5-phenyl-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;5-phenyl-7-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidine-4,7-diamine
PubChem CID158012289
Molecular FormulaC175H135Br4Cl6N64+7
Molecular Weight3666.79 g/mol
Exact Mass3657.74
IUPAC Name7-amino-4-(aminomethyl)-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;4-amino-3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;7-amino-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;4-(aminomethyl)-3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;4-(aminomethyl)-5-phenyl-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidin-7-amine;3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;3-bromo-5-phenyl-7-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidine-4,7-diamine;4,7-diamino-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;5-phenyl-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;5-phenyl-7-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidine-4,7-diamine
SMILESN#C[n+]1c(-c2ccccc2Cl)c(CN)c2c(Br)cnn2c1NCc1cccnc1.N#C[n+]1c(-c2ccccc2Cl)c(CN)c2ccnn2c1N.N#C[n+]1c(-c2ccccc2Cl)c(N)c2c(Br)cnn2c1NCc1cccnc1.N#C[n+]1c(-c2ccccc2Cl)c(N)c2ccnn2c1N.N#Cc1c(-c2ccccc2)[n+](C#N)c(NCc2cccnc2)n2nccc12.N#Cc1c(-c2ccccc2Cl)[n+](C#N)c(N)n2nccc12.N#Cc1c(-c2ccccc2Cl)[n+](C#N)c(NCc2cccnc2)n2ncc(Br)c12.NCc1c(-c2ccccc2)nc(NCc2cccnc2)n2nccc12.Nc1c(-c2ccccc2)nc(NCc2cccnc2)n2ncc(Br)c12.Nc1c(-c2ccccc2)nc(NCc2cccnc2)n2nccc12
InChIInChI=1S/C20H15BrClN7.C20H11BrClN7.C20H13N7.C19H13BrClN7.C19H18N6.C18H15BrN6.C18H16N6.C14H11ClN6.C14H7ClN6.C13H9ClN6/c2*21-16-11-27-29-19(16)15(8-23)18(14-5-1-2-6-17(14)22)28(12-24)20(29)26-10-13-4-3-7-25-9-13;21-11-17-18-8-10-25-27(18)20(24-13-15-5-4-9-23-12-15)26(14-22)19(17)16-6-2-1-3-7-16;20-14-10-26-28-18(14)16(23)17(13-5-1-2-6-15(13)21)27(11-22)19(28)25-9-12-4-3-7-24-8-12;20-11-16-17-8-10-23-25(17)19(22-13-14-5-4-9-21-12-14)24-18(16)15-6-2-1-3-7-15;19-14-11-23-25-17(14)15(20)16(13-6-2-1-3-7-13)24-18(25)22-10-12-5-4-8-21-9-12;19-16-15-8-10-22-24(15)18(21-12-13-5-4-9-20-11-13)23-17(16)14-6-2-1-3-7-14;2*15-11-4-2-1-3-9(11)13-10(7-16)12-5-6-19-21(12)14(18)20(13)8-17;14-9-4-2-1-3-8(9)12-11(16)10-5-6-18-20(10)13(17)19(12)7-15/h1-7,9,11H,8,10,23H2;1-7,9,11H,10H2;1-10,12H,13H2;1-8,10H,9,23H2;1-10,12H,11,13,20H2,(H,22,24);1-9,11H,10,20H2,(H,22,24);1-11H,12,19H2,(H,21,23);1-6,18H,7,16H2;1-6,18H;1-6,17H,16H2/p+7
InChIKeyPPCIARUEYXOIEA-UHFFFAOYSA-U
XLogP27.60
TPSA911.37 Ų
H-Bond Donors17
H-Bond Acceptors57
Rotatable Bonds34
Heavy Atoms249
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003666.79
LogP ≤ 527.60
H-Bond Donors ≤ 517
H-Bond Acceptors ≤ 1057

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Analyze 7-amino-4-(aminomethyl)-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;4-amino-3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;7-amino-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;4-(aminomethyl)-3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;4-(aminomethyl)-5-phenyl-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidin-7-amine;3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;3-bromo-5-phenyl-7-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidine-4,7-diamine;4,7-diamino-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;5-phenyl-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;5-phenyl-7-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidine-4,7-diamine with MolForge

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Related Compounds

5-Amino-7-phenyl-[1,2,4]triazolo[4,3-c]pyrimidine-8-carbonitrile;8-(2-chloro-6-methyl-4-pyridinyl)-7-(4-fluorophenyl)-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine;7-(4-chlorophenyl)-8-[2-methyl-6-(trifluoromethyl)-4-pyridinyl]-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine;7-(4-fluorophenyl)-8-[2-methyl-6-(trifluoromethyl)-4-pyridinyl]-[1,2,4]triazolo[4,3-c]pyrimidin-5-amine;8-[2-methyl-6-(trifluoromethyl)-4-pyridinyl]-7-phenylimidazo[1,2-c]pyrimidin-5-amine
CID 157934794
5-bromo-2-(2-chloro-6-fluorophenyl)-1H-pyrrolo[2,3-b]pyridine;5-bromo-2-chloro-3-methylpyridine;2-chloro-6-fluorobenzonitrile;bis(2-(2-chloro-6-fluorophenyl)-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-1H-pyrrolo[2,3-b]pyridine)
CID 159792487
3-bromo-5-tert-butyl-N-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-7-amine;3-bromo-5-(2-chlorophenyl)-N-pyridin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;3-bromo-5-(2-chlorophenyl)-N-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-7-amine;3-bromo-5-(2-fluorophenyl)-N-pyridin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;3-bromo-5-(2-fluorophenyl)-N-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-7-amine;3-bromo-5-phenyl-N-pyridin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;3-bromo-5-phenyl-N-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-7-amine;3-bromo-5-propan-2-yl-N-pyridin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;3-bromo-5-propan-2-yl-N-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-7-amine;3-bromo-N-pyridin-3-yl-5-[3-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyrimidin-7-amine;3-chloro-5-(2-fluorophenyl)-N-pyridin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine;3-chloro-5-(2-fluorophenyl)-N-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-7-amine
CID 160437289
5-Bromo-1-[(5-chloro-6-methyl-3-pyridinyl)methyl]indazole;5-bromo-1-[(5,6-dimethyl-3-pyridinyl)methyl]indole;5-[(2-bromoimidazol-1-yl)methyl]-2,3-difluoro-4-methylpyridine;5-[(4-bromopyrazol-1-yl)methyl]-3-fluoro-2-methylpyridine;5-[(5-bromotetrazol-2-yl)methyl]-2,6-dimethylpyridine-3-carbonitrile;5-[(4-bromotriazol-2-yl)methyl]-2-methylpyridine-3-carbonitrile;5-[(4,5-dibromotriazol-2-yl)methyl]-2-methyl-3-(trifluoromethyl)pyridine;2,4-dimethyl-5-(1,2,4-triazol-1-ylmethyl)pyridine-3-carbonitrile;methane;1-[(2,5,6-trimethyl-3-pyridinyl)methyl]pyrrolo[2,3-b]pyridine
CID 161068890
3-Bromo-5-(2-chlorophenyl)-6-isocyano-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyridine-4-carbonitrile;5-(2-chlorophenyl)-6-isocyano-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyridine-4-carbonitrile
CID 157132924
4-Amino-3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyridine-6-carbonitrile;4-(aminomethyl)-3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyridine-6-carbonitrile
CID 157138815
5-amino-3-bromo-6-(2-chlorophenyl)-8-(pyridin-3-ylmethylamino)imidazo[1,2-a]pyridine-7-carbonitrile;8-amino-6-(2-chlorophenyl)imidazo[1,2-a]pyridine-5,7-dicarbonitrile;5-(aminomethyl)-3-bromo-6-phenyl-N-(pyridin-3-ylmethyl)imidazo[1,2-a]pyridin-8-amine;5-(aminomethyl)-6-phenyl-N-(pyridin-3-ylmethyl)imidazo[1,2-a]pyridin-8-amine;3-bromo-6-(2-chlorophenyl)-8-(pyridin-3-ylmethylamino)imidazo[1,2-a]pyridine-5,7-dicarbonitrile;3-bromo-6-phenyl-8-(pyridin-3-ylmethylamino)imidazo[1,2-a]pyridine-5-carbonitrile;3-bromo-6-phenyl-8-N-(pyridin-3-ylmethyl)imidazo[1,2-a]pyrazine-5,8-diamine;6-(2-chlorophenyl)-8-(pyridin-3-ylmethylamino)imidazo[1,2-a]pyridine-5,7-dicarbonitrile;6-phenyl-8-(pyridin-3-ylmethylamino)imidazo[1,2-a]pyridine-5-carbonitrile;6-phenyl-8-N-(pyridin-3-ylmethyl)imidazo[1,2-a]pyridine-5,8-diamine
CID 157183822
3-bromo-5-(2-chlorophenyl)-N-(pyridin-3-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine;3-bromo-5-(2-chlorophenyl)-N-(pyridin-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine;3-bromo-5-(2-fluorophenyl)-N-(pyridin-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine;3-bromo-5-phenyl-N-(pyridin-3-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine;3-bromo-5-phenyl-N-(pyridin-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine;3-bromo-5-propan-2-yl-N-(pyridin-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine;3-chloro-5-(2-fluorophenyl)-N-(pyridin-3-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine;3-chloro-5-(2-fluorophenyl)-N-(pyridin-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 157249884
6-[5-(2-Aminopyrimidin-5-yl)-1-tert-butylbenzimidazol-2-yl]-5-(3-methyl-1,2,4-triazol-1-yl)pyridine-2-carbonitrile;6-[5-(2-aminopyrimidin-5-yl)-1-tert-butylbenzimidazol-2-yl]-5-(5-methyl-1,2,4-triazol-1-yl)pyridine-2-carbonitrile;6-[5-(2-aminopyrimidin-5-yl)-1-tert-butylbenzimidazol-2-yl]-5-(1,2,4-triazol-1-yl)pyridine-2-carbonitrile;5-[2-(2-bromo-4-pyridinyl)-1-tert-butylbenzimidazol-5-yl]pyrimidin-2-amine;5-(1-tert-butyl-2-pyridin-4-ylbenzimidazol-5-yl)pyrimidin-2-amine;5-[1-tert-butyl-2-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]benzimidazol-5-yl]pyrimidin-2-amine
CID 157282263
7-Amino-4-(aminomethyl)-5-(2-chlorophenyl)pyrazolo[1,5-a]pyridine-6-carbonitrile;7-amino-5-(2-chlorophenyl)pyrazolo[1,5-a]pyridine-4,6-dicarbonitrile;4-amino-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyridine-6-carbonitrile;4-(aminomethyl)-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyridine-6-carbonitrile;3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyridine-4,6-dicarbonitrile;5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-a]pyridine-4,6-dicarbonitrile;4,7-diamino-5-(2-chlorophenyl)pyrazolo[1,5-a]pyridine-6-carbonitrile
CID 157352295
6-[5-(2-Aminopyrimidin-5-yl)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-5-(3-methyl-1,2,4-triazol-1-yl)pyridine-2-carbonitrile;6-[5-(2-aminopyrimidin-5-yl)-1-(1-methylcyclobutyl)benzimidazol-2-yl]-5-(5-methyltriazol-1-yl)pyridine-2-carbonitrile;5-[2-[5-bromo-2-(1,2,4-triazol-1-yl)-3-pyridinyl]-1-tert-butylbenzimidazol-5-yl]pyrimidin-2-amine;5-[1-tert-butyl-2-[5-chloro-2-(1,2,4-triazol-1-yl)-3-pyridinyl]benzimidazol-5-yl]pyrimidin-2-amine;5-[1-tert-butyl-2-[6-cyclopropyl-3-(1,2,4-triazol-1-yl)-2-pyridinyl]benzimidazol-5-yl]pyrimidin-2-amine;5-[1-tert-butyl-2-[5-fluoro-2-(1,2,4-triazol-1-yl)-3-pyridinyl]benzimidazol-5-yl]pyrimidin-2-amine
CID 157384219
3-bromo-6-[(6-methyl-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methyl]quinoline;6-[(6-chloro-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methyl]-5,7-difluoroquinoline;6-[(6-cyclopropyl-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methyl]quinoline;6-[(6-ethenyl-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methyl]quinoline;6-[[6-(4-methylpiperazin-1-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl]quinoline;6-(1-methylpyrazol-4-yl)-3-(1H-pyrrolo[2,3-b]pyridin-3-ylmethyl)-[1,2,4]triazolo[4,3-b]pyridazine;6-[(6-methyl-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methyl]quinoline-3-carbonitrile;6-[(6-piperidin-1-yl-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methyl]quinoline
CID 157452857

Frequently Asked Questions

What is the IUPAC name of 7-amino-4-(aminomethyl)-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;4-amino-3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;7-amino-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;4-(aminomethyl)-3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;4-(aminomethyl)-5-phenyl-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidin-7-amine;3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;3-bromo-5-phenyl-7-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidine-4,7-diamine;4,7-diamino-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;5-phenyl-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;5-phenyl-7-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidine-4,7-diamine?
The IUPAC name of 7-amino-4-(aminomethyl)-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;4-amino-3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;7-amino-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;4-(aminomethyl)-3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;4-(aminomethyl)-5-phenyl-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidin-7-amine;3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;3-bromo-5-phenyl-7-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidine-4,7-diamine;4,7-diamino-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;5-phenyl-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;5-phenyl-7-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidine-4,7-diamine (CID 158012289) is 7-amino-4-(aminomethyl)-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;4-amino-3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;7-amino-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;4-(aminomethyl)-3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;4-(aminomethyl)-5-phenyl-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidin-7-amine;3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;3-bromo-5-phenyl-7-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidine-4,7-diamine;4,7-diamino-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;5-phenyl-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;5-phenyl-7-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidine-4,7-diamine.
What is the SMILES notation for 7-amino-4-(aminomethyl)-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;4-amino-3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;7-amino-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;4-(aminomethyl)-3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;4-(aminomethyl)-5-phenyl-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidin-7-amine;3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;3-bromo-5-phenyl-7-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidine-4,7-diamine;4,7-diamino-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;5-phenyl-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;5-phenyl-7-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidine-4,7-diamine?
The canonical SMILES for 7-amino-4-(aminomethyl)-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;4-amino-3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;7-amino-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;4-(aminomethyl)-3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;4-(aminomethyl)-5-phenyl-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidin-7-amine;3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;3-bromo-5-phenyl-7-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidine-4,7-diamine;4,7-diamino-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;5-phenyl-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;5-phenyl-7-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidine-4,7-diamine is N#C[n+]1c(-c2ccccc2Cl)c(CN)c2c(Br)cnn2c1NCc1cccnc1.N#C[n+]1c(-c2ccccc2Cl)c(CN)c2ccnn2c1N.N#C[n+]1c(-c2ccccc2Cl)c(N)c2c(Br)cnn2c1NCc1cccnc1.N#C[n+]1c(-c2ccccc2Cl)c(N)c2ccnn2c1N.N#Cc1c(-c2ccccc2)[n+](C#N)c(NCc2cccnc2)n2nccc12.N#Cc1c(-c2ccccc2Cl)[n+](C#N)c(N)n2nccc12.N#Cc1c(-c2ccccc2Cl)[n+](C#N)c(NCc2cccnc2)n2ncc(Br)c12.NCc1c(-c2ccccc2)nc(NCc2cccnc2)n2nccc12.Nc1c(-c2ccccc2)nc(NCc2cccnc2)n2ncc(Br)c12.Nc1c(-c2ccccc2)nc(NCc2cccnc2)n2nccc12.
What is the InChIKey of 7-amino-4-(aminomethyl)-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;4-amino-3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;7-amino-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;4-(aminomethyl)-3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;4-(aminomethyl)-5-phenyl-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidin-7-amine;3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;3-bromo-5-phenyl-7-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidine-4,7-diamine;4,7-diamino-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;5-phenyl-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;5-phenyl-7-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidine-4,7-diamine?
The InChIKey is PPCIARUEYXOIEA-UHFFFAOYSA-U. The full InChI is InChI=1S/C20H15BrClN7.C20H11BrClN7.C20H13N7.C19H13BrClN7.C19H18N6.C18H15BrN6.C18H16N6.C14H11ClN6.C14H7ClN6.C13H9ClN6/c2*21-16-11-27-29-19(16)15(8-23)18(14-5-1-2-6-17(14)22)28(12-24)20(29)26-10-13-4-3-7-25-9-13;21-11-17-18-8-10-25-27(18)20(24-13-15-5-4-9-23-12-15)26(14-22)19(17)16-6-2-1-3-7-16;20-14-10-26-28-18(14)16(23)17(13-5-1-2-6-15(13)21)27(11-22)19(28)25-9-12-4-3-7-24-8-12;20-11-16-17-8-10-23-25(17)19(22-13-14-5-4-9-21-12-14)24-18(16)15-6-2-1-3-7-15;19-14-11-23-25-17(14)15(20)16(13-6-2-1-3-7-13)24-18(25)22-10-12-5-4-8-21-9-12;19-16-15-8-10-22-24(15)18(21-12-13-5-4-9-20-11-13)23-17(16)14-6-2-1-3-7-14;2*15-11-4-2-1-3-9(11)13-10(7-16)12-5-6-19-21(12)14(18)20(13)8-17;14-9-4-2-1-3-8(9)12-11(16)10-5-6-18-20(10)13(17)19(12)7-15/h1-7,9,11H,8,10,23H2;1-7,9,11H,10H2;1-10,12H,13H2;1-8,10H,9,23H2;1-10,12H,11,13,20H2,(H,22,24);1-9,11H,10,20H2,(H,22,24);1-11H,12,19H2,(H,21,23);1-6,18H,7,16H2;1-6,18H;1-6,17H,16H2/p+7.
What are the key properties of 7-amino-4-(aminomethyl)-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;4-amino-3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;7-amino-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;4-(aminomethyl)-3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;4-(aminomethyl)-5-phenyl-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidin-7-amine;3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;3-bromo-5-phenyl-7-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidine-4,7-diamine;4,7-diamino-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;5-phenyl-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;5-phenyl-7-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidine-4,7-diamine?
7-amino-4-(aminomethyl)-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;4-amino-3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;7-amino-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;4-(aminomethyl)-3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;4-(aminomethyl)-5-phenyl-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidin-7-amine;3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;3-bromo-5-phenyl-7-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidine-4,7-diamine;4,7-diamino-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;5-phenyl-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;5-phenyl-7-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidine-4,7-diamine has a molecular weight of 3666.79 g/mol, XLogP of 27.60, 34 rotatable bonds, 17 hydrogen bond donors, and 57 hydrogen bond acceptors.
Where does this data come from?
All data for 7-amino-4-(aminomethyl)-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;4-amino-3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;7-amino-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;4-(aminomethyl)-3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;4-(aminomethyl)-5-phenyl-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidin-7-amine;3-bromo-5-(2-chlorophenyl)-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;3-bromo-5-phenyl-7-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidine-4,7-diamine;4,7-diamino-5-(2-chlorophenyl)pyrazolo[1,5-c]pyrimidin-6-ium-6-carbonitrile;5-phenyl-7-(pyridin-3-ylmethylamino)pyrazolo[1,5-c]pyrimidin-6-ium-4,6-dicarbonitrile;5-phenyl-7-N-(pyridin-3-ylmethyl)pyrazolo[1,5-c]pyrimidine-4,7-diamine is sourced from PubChem (CID 158012289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).