6-[7-(N,4-dimethylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(2-fluoro-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(3-fluoro-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(2-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(3-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(4-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid

C148H126F2N24O15 — CID 160530945

IUPAC6-[7-(N,4-dimethylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(2-fluoro-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(3-fluoro-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(2-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(3-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(4-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid
SMILESCN(c1cccc(F)c1)c1cccc2c(C3=Cc4nccc(C(=O)O)c4C3)nn(C)c12.CN(c1ccccc1F)c1cccc2c(C3=Cc4nccc(C(=O)O)c4C3)nn(C)c12.COc1ccc(N(C)c2cccc3c(C4=Cc5nccc(C(=O)O)c5C4)nn(C)c23)cc1.COc1cccc(N(C)c2cccc3c(C4=Cc5nccc(C(=O)O)c5C4)nn(C)c23)c1.COc1ccccc1N(C)c1cccc2c(C3=Cc4nccc(C(=O)O)c4C3)nn(C)c12.Cc1ccc(N(C)c2cccc3c(C4=Cc5nccc(C(=O)O)c5C4)nn(C)c23)cc1
InChIInChI=1S/3C25H22N4O3.C25H22N4O2.2C24H19FN4O2/c1-28(16-6-4-7-17(14-16)32-3)22-9-5-8-19-23(27-29(2)24(19)22)15-12-20-18(25(30)31)10-11-26-21(20)13-15;1-28(20-8-4-5-10-22(20)32-3)21-9-6-7-17-23(27-29(2)24(17)21)15-13-18-16(25(30)31)11-12-26-19(18)14-15;1-28(16-7-9-17(32-3)10-8-16)22-6-4-5-19-23(27-29(2)24(19)22)15-13-20-18(25(30)31)11-12-26-21(20)14-15;1-15-7-9-17(10-8-15)28(2)22-6-4-5-19-23(27-29(3)24(19)22)16-13-20-18(25(30)31)11-12-26-21(20)14-16;1-28(16-6-3-5-15(25)13-16)21-8-4-7-18-22(27-29(2)23(18)21)14-11-19-17(24(30)31)9-10-26-20(19)12-14;1-28(20-8-4-3-7-18(20)25)21-9-5-6-16-22(27-29(2)23(16)21)14-12-17-15(24(30)31)10-11-26-19(17)13-14/h4-11,13-14H,12H2,1-3H3,(H,30,31);2*4-12,14H,13H2,1-3H3,(H,30,31);4-12,14H,13H2,1-3H3,(H,30,31);3-10,12-13H,11H2,1-2H3,(H,30,31);3-11,13H,12H2,1-2H3,(H,30,31)
InChIKeyQVNGOGZUVKSPTB-UHFFFAOYSA-N
MW2518.78 g/mol
LogP27.80
Rot. Bonds27

About 6-[7-(N,4-dimethylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(2-fluoro-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(3-fluoro-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(2-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(3-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(4-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid

6-[7-(N,4-dimethylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(2-fluoro-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(3-fluoro-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(2-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(3-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(4-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid (PubChem CID 160530945) has the molecular formula C148H126F2N24O15 and a molecular weight of 2518.78 g/mol. Its IUPAC name is 6-[7-(N,4-dimethylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(2-fluoro-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(3-fluoro-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(2-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(3-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(4-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid.

Molecular Properties

Compound Name6-[7-(N,4-dimethylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(2-fluoro-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(3-fluoro-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(2-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(3-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(4-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid
PubChem CID160530945
Molecular FormulaC148H126F2N24O15
Molecular Weight2518.78 g/mol
Exact Mass2516.98
IUPAC Name6-[7-(N,4-dimethylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(2-fluoro-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(3-fluoro-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(2-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(3-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(4-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid
SMILESCN(c1cccc(F)c1)c1cccc2c(C3=Cc4nccc(C(=O)O)c4C3)nn(C)c12.CN(c1ccccc1F)c1cccc2c(C3=Cc4nccc(C(=O)O)c4C3)nn(C)c12.COc1ccc(N(C)c2cccc3c(C4=Cc5nccc(C(=O)O)c5C4)nn(C)c23)cc1.COc1cccc(N(C)c2cccc3c(C4=Cc5nccc(C(=O)O)c5C4)nn(C)c23)c1.COc1ccccc1N(C)c1cccc2c(C3=Cc4nccc(C(=O)O)c4C3)nn(C)c12.Cc1ccc(N(C)c2cccc3c(C4=Cc5nccc(C(=O)O)c5C4)nn(C)c23)cc1
InChIInChI=1S/3C25H22N4O3.C25H22N4O2.2C24H19FN4O2/c1-28(16-6-4-7-17(14-16)32-3)22-9-5-8-19-23(27-29(2)24(19)22)15-12-20-18(25(30)31)10-11-26-21(20)13-15;1-28(20-8-4-5-10-22(20)32-3)21-9-6-7-17-23(27-29(2)24(17)21)15-13-18-16(25(30)31)11-12-26-19(18)14-15;1-28(16-7-9-17(32-3)10-8-16)22-6-4-5-19-23(27-29(2)24(19)22)15-13-20-18(25(30)31)11-12-26-21(20)14-15;1-15-7-9-17(10-8-15)28(2)22-6-4-5-19-23(27-29(3)24(19)22)16-13-20-18(25(30)31)11-12-26-21(20)14-16;1-28(16-6-3-5-15(25)13-16)21-8-4-7-18-22(27-29(2)23(18)21)14-11-19-17(24(30)31)9-10-26-20(19)12-14;1-28(20-8-4-3-7-18(20)25)21-9-5-6-16-22(27-29(2)23(16)21)14-12-17-15(24(30)31)10-11-26-19(17)13-14/h4-11,13-14H,12H2,1-3H3,(H,30,31);2*4-12,14H,13H2,1-3H3,(H,30,31);4-12,14H,13H2,1-3H3,(H,30,31);3-10,12-13H,11H2,1-2H3,(H,30,31);3-11,13H,12H2,1-2H3,(H,30,31)
InChIKeyQVNGOGZUVKSPTB-UHFFFAOYSA-N
XLogP27.80
TPSA455.19 Ų
H-Bond Donors6
H-Bond Acceptors33
Rotatable Bonds27
Heavy Atoms189
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002518.78
LogP ≤ 527.80
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1033

Analyze 6-[7-(N,4-dimethylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(2-fluoro-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(3-fluoro-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(2-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(3-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(4-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid with MolForge

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Launch Full Analysis

Related Compounds

N-[2-[4-[[3-[1-(2,6-dioxopiperidin-3-yl)-3-methyl-2-oxobenzimidazol-5-yl]azetidin-1-yl]-[(1R,5S)-3-[2-[1-(2,6-dioxopiperidin-3-yl)-3-methyl-2-oxobenzimidazol-4-yl]ethyl]-8-[[4-[6-(2-hydroxypropan-2-yl)-5-[[6-(trifluoromethyl)pyridine-2-carbonyl]amino]indazol-2-yl]cyclohexyl]methyl]-3,8-diazabicyclo[3.2.1]octan-6-yl]methyl]cyclohexyl]-6-methoxyindazol-5-yl]-6-(2-fluoropropan-2-yl)pyridine-2-carboxamide
CID 155448983
6-[7-(3-cyclopropyl-N-methylanilino)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(3-ethynyl-N-methylanilino)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(4-ethynyl-N-methylanilino)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(4-methoxy-N-methylanilino)-2-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[2-methyl-7-[N-methyl-3-(trifluoromethoxy)anilino]indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid
CID 157100372
1-(5-Fluoro-2-pyridinyl)indole-5-carboxylic acid;1-(2-methoxy-4-pyridinyl)indole-5-carboxylic acid;1-(6-methoxy-3-pyridinyl)indole-5-carboxylic acid;1-(6-methyl-3-pyridinyl)indole-5-carboxylic acid;1-pyridin-2-ylindole-5-carboxylic acid;1-pyridin-3-ylindole-5-carboxylic acid;1-pyridin-4-ylindole-5-carboxylic acid;1-[4-(trifluoromethyl)phenyl]indazole-5-carboxylic acid;1-[5-(trifluoromethyl)-2-pyridinyl]indole-5-carboxylic acid
CID 157196375
1-(3,4-Difluorophenyl)indazole-5-carboxylic acid;1-(3-fluorophenyl)indazole-5-carboxylic acid;1-(4-fluorophenyl)indazole-5-carboxylic acid;1-(2-methoxy-4-pyridinyl)indole-5-carboxylic acid;1-[4-(trifluoromethyl)phenyl]indazole-5-carboxylic acid
CID 157275312
6-(5-cyclopropyl-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(2,5-dimethylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(2,6-dimethylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(5-methoxy-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-(6-methoxy-2-methylindazol-3-yl)-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[2-methyl-5-(trifluoromethoxy)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid
CID 157363888
1-(3,4-Difluorophenyl)indazole-5-carboxylic acid;1-(3-fluorophenyl)indazole-5-carboxylic acid;1-(2-methoxy-4-pyridinyl)indole-5-carboxylic acid;1-(6-methyl-3-pyridinyl)indole-5-carboxylic acid;1-[4-(trifluoromethyl)phenyl]indazole-5-carboxylic acid
CID 157454685
1-(3,4-Difluorophenyl)indazole-5-carboxylic acid;1-(3-fluorophenyl)indazole-5-carboxylic acid;1-(2-methoxy-4-pyridinyl)indole-5-carboxylic acid;1-(6-methoxy-3-pyridinyl)indole-5-carboxylic acid;1-(6-methyl-3-pyridinyl)indole-5-carboxylic acid;1-[4-(trifluoromethyl)phenyl]indazole-5-carboxylic acid
CID 157686472
1-(3-Fluorophenyl)indazole-5-carboxylic acid;1-(2-methoxy-4-pyridinyl)indole-5-carboxylic acid;1-(6-methoxy-3-pyridinyl)indole-5-carboxylic acid;1-(6-methyl-3-pyridinyl)indole-5-carboxylic acid;1-pyridin-4-ylindole-5-carboxylic acid;1-[4-(trifluoromethyl)phenyl]indazole-5-carboxylic acid
CID 158879236
1-(3,4-Difluorophenyl)indazole-5-carboxylic acid;1-(3-fluorophenyl)indazole-5-carboxylic acid;1-(4-fluorophenyl)indazole-5-carboxylic acid;1-(2-methoxy-4-pyridinyl)indazole-5-carboxylic acid;1-[4-(trifluoromethyl)phenyl]indazole-5-carboxylic acid
CID 158912201
N-(2-cyclohexyl-6-methoxyindazol-5-yl)-6-(trifluoromethyl)pyridine-2-carboxamide;N-(2-cyclohexyl-6-methoxy-3-methylindazol-5-yl)-6-(trifluoromethyl)pyridine-2-carboxamide;methane;N-[6-methoxy-3-methyl-2-(1-methylpiperidin-4-yl)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[6-methoxy-2-(1-methylpiperidin-4-yl)indazol-5-yl]-3-(trifluoromethyl)benzamide;N-[6-methoxy-2-(1-methylpiperidin-4-yl)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide
CID 159082886
1-(3-Fluorophenyl)indazole-5-carboxylic acid;1-(2-methoxy-4-pyridinyl)indole-5-carboxylic acid;1-(6-methoxy-3-pyridinyl)indole-5-carboxylic acid;1-(6-methyl-3-pyridinyl)indole-5-carboxylic acid;1-[4-(trifluoromethyl)phenyl]indazole-5-carboxylic acid
CID 160382954
6-[1-(cyclopropylmethyl)-7-(N-methylanilino)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(3,4-dihydro-2H-quinolin-1-yl)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(N-ethylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[1-ethyl-7-(N-methylanilino)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[1-(2-hydroxyethyl)-7-(N-methylanilino)indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[1-methyl-7-[N-methyl-3-(trifluoromethoxy)anilino]indazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid
CID 161214746

Frequently Asked Questions

What is the IUPAC name of 6-[7-(N,4-dimethylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(2-fluoro-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(3-fluoro-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(2-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(3-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(4-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid?
The IUPAC name of 6-[7-(N,4-dimethylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(2-fluoro-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(3-fluoro-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(2-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(3-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(4-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid (CID 160530945) is 6-[7-(N,4-dimethylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(2-fluoro-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(3-fluoro-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(2-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(3-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(4-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid.
What is the SMILES notation for 6-[7-(N,4-dimethylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(2-fluoro-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(3-fluoro-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(2-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(3-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(4-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid?
The canonical SMILES for 6-[7-(N,4-dimethylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(2-fluoro-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(3-fluoro-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(2-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(3-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(4-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid is CN(c1cccc(F)c1)c1cccc2c(C3=Cc4nccc(C(=O)O)c4C3)nn(C)c12.CN(c1ccccc1F)c1cccc2c(C3=Cc4nccc(C(=O)O)c4C3)nn(C)c12.COc1ccc(N(C)c2cccc3c(C4=Cc5nccc(C(=O)O)c5C4)nn(C)c23)cc1.COc1cccc(N(C)c2cccc3c(C4=Cc5nccc(C(=O)O)c5C4)nn(C)c23)c1.COc1ccccc1N(C)c1cccc2c(C3=Cc4nccc(C(=O)O)c4C3)nn(C)c12.Cc1ccc(N(C)c2cccc3c(C4=Cc5nccc(C(=O)O)c5C4)nn(C)c23)cc1.
What is the InChIKey of 6-[7-(N,4-dimethylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(2-fluoro-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(3-fluoro-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(2-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(3-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(4-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid?
The InChIKey is QVNGOGZUVKSPTB-UHFFFAOYSA-N. The full InChI is InChI=1S/3C25H22N4O3.C25H22N4O2.2C24H19FN4O2/c1-28(16-6-4-7-17(14-16)32-3)22-9-5-8-19-23(27-29(2)24(19)22)15-12-20-18(25(30)31)10-11-26-21(20)13-15;1-28(20-8-4-5-10-22(20)32-3)21-9-6-7-17-23(27-29(2)24(17)21)15-13-18-16(25(30)31)11-12-26-19(18)14-15;1-28(16-7-9-17(32-3)10-8-16)22-6-4-5-19-23(27-29(2)24(19)22)15-13-20-18(25(30)31)11-12-26-21(20)14-15;1-15-7-9-17(10-8-15)28(2)22-6-4-5-19-23(27-29(3)24(19)22)16-13-20-18(25(30)31)11-12-26-21(20)14-16;1-28(16-6-3-5-15(25)13-16)21-8-4-7-18-22(27-29(2)23(18)21)14-11-19-17(24(30)31)9-10-26-20(19)12-14;1-28(20-8-4-3-7-18(20)25)21-9-5-6-16-22(27-29(2)23(16)21)14-12-17-15(24(30)31)10-11-26-19(17)13-14/h4-11,13-14H,12H2,1-3H3,(H,30,31);2*4-12,14H,13H2,1-3H3,(H,30,31);4-12,14H,13H2,1-3H3,(H,30,31);3-10,12-13H,11H2,1-2H3,(H,30,31);3-11,13H,12H2,1-2H3,(H,30,31).
What are the key properties of 6-[7-(N,4-dimethylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(2-fluoro-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(3-fluoro-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(2-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(3-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(4-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid?
6-[7-(N,4-dimethylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(2-fluoro-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(3-fluoro-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(2-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(3-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(4-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid has a molecular weight of 2518.78 g/mol, XLogP of 27.80, 27 rotatable bonds, 6 hydrogen bond donors, and 33 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[7-(N,4-dimethylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(2-fluoro-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(3-fluoro-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(2-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(3-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid;6-[7-(4-methoxy-N-methylanilino)-1-methylindazol-3-yl]-5H-cyclopenta[b]pyridine-4-carboxylic acid is sourced from PubChem (CID 160530945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).