2-chloro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2-chloro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide;2-fluoro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide

C129H100Cl2F6N24O9S3 — CID 159232062

IUPAC2-chloro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2-chloro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide;2-fluoro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide
SMILESCOc1cccc(-c2cc(-c3ccc(NC(=O)c4c(F)cccc4F)nc3)n(C)n2)c1.COc1cccc(-c2cc(-c3ccc(NC(=O)c4ccccc4Cl)nc3)n(C)n2)c1.COc1cccc(-c2cc(-c3ccc(NC(=O)c4ccccc4F)nc3)n(C)n2)c1.Cn1nc(-c2cccs2)cc1-c1ccc(NC(=O)c2c(F)cccc2F)nc1.Cn1nc(-c2cccs2)cc1-c1ccc(NC(=O)c2ccccc2Cl)nc1.Cn1nc(-c2cccs2)cc1-c1ccc(NC(=O)c2ccccc2F)nc1
InChIInChI=1S/C23H19ClN4O2.C23H18F2N4O2.C23H19FN4O2.C20H15ClN4OS.C20H14F2N4OS.C20H15FN4OS/c1-28-21(13-20(27-28)15-6-5-7-17(12-15)30-2)16-10-11-22(25-14-16)26-23(29)18-8-3-4-9-19(18)24;1-29-20(12-19(28-29)14-5-3-6-16(11-14)31-2)15-9-10-21(26-13-15)27-23(30)22-17(24)7-4-8-18(22)25;1-28-21(13-20(27-28)15-6-5-7-17(12-15)30-2)16-10-11-22(25-14-16)26-23(29)18-8-3-4-9-19(18)24;1-25-17(11-16(24-25)18-7-4-10-27-18)13-8-9-19(22-12-13)23-20(26)14-5-2-3-6-15(14)21;1-26-16(10-15(25-26)17-6-3-9-28-17)12-7-8-18(23-11-12)24-20(27)19-13(21)4-2-5-14(19)22;1-25-17(11-16(24-25)18-7-4-10-27-18)13-8-9-19(22-12-13)23-20(26)14-5-2-3-6-15(14)21/h3-14H,1-2H3,(H,25,26,29);3-13H,1-2H3,(H,26,27,30);3-14H,1-2H3,(H,25,26,29);2-12H,1H3,(H,22,23,26);2-11H,1H3,(H,23,24,27);2-12H,1H3,(H,22,23,26)
InChIKeyKTAJIAXHIIKTAS-UHFFFAOYSA-N
MW2411.47 g/mol
LogP28.76
Rot. Bonds27

About 2-chloro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2-chloro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide;2-fluoro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide

2-chloro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2-chloro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide;2-fluoro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide (PubChem CID 159232062) has the molecular formula C129H100Cl2F6N24O9S3 and a molecular weight of 2411.47 g/mol. Its IUPAC name is 2-chloro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2-chloro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide;2-fluoro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide.

Molecular Properties

Compound Name2-chloro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2-chloro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide;2-fluoro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide
PubChem CID159232062
Molecular FormulaC129H100Cl2F6N24O9S3
Molecular Weight2411.47 g/mol
Exact Mass2408.65
IUPAC Name2-chloro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2-chloro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide;2-fluoro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide
SMILESCOc1cccc(-c2cc(-c3ccc(NC(=O)c4c(F)cccc4F)nc3)n(C)n2)c1.COc1cccc(-c2cc(-c3ccc(NC(=O)c4ccccc4Cl)nc3)n(C)n2)c1.COc1cccc(-c2cc(-c3ccc(NC(=O)c4ccccc4F)nc3)n(C)n2)c1.Cn1nc(-c2cccs2)cc1-c1ccc(NC(=O)c2c(F)cccc2F)nc1.Cn1nc(-c2cccs2)cc1-c1ccc(NC(=O)c2ccccc2Cl)nc1.Cn1nc(-c2cccs2)cc1-c1ccc(NC(=O)c2ccccc2F)nc1
InChIInChI=1S/C23H19ClN4O2.C23H18F2N4O2.C23H19FN4O2.C20H15ClN4OS.C20H14F2N4OS.C20H15FN4OS/c1-28-21(13-20(27-28)15-6-5-7-17(12-15)30-2)16-10-11-22(25-14-16)26-23(29)18-8-3-4-9-19(18)24;1-29-20(12-19(28-29)14-5-3-6-16(11-14)31-2)15-9-10-21(26-13-15)27-23(30)22-17(24)7-4-8-18(22)25;1-28-21(13-20(27-28)15-6-5-7-17(12-15)30-2)16-10-11-22(25-14-16)26-23(29)18-8-3-4-9-19(18)24;1-25-17(11-16(24-25)18-7-4-10-27-18)13-8-9-19(22-12-13)23-20(26)14-5-2-3-6-15(14)21;1-26-16(10-15(25-26)17-6-3-9-28-17)12-7-8-18(23-11-12)24-20(27)19-13(21)4-2-5-14(19)22;1-25-17(11-16(24-25)18-7-4-10-27-18)13-8-9-19(22-12-13)23-20(26)14-5-2-3-6-15(14)21/h3-14H,1-2H3,(H,25,26,29);3-13H,1-2H3,(H,26,27,30);3-14H,1-2H3,(H,25,26,29);2-12H,1H3,(H,22,23,26);2-11H,1H3,(H,23,24,27);2-12H,1H3,(H,22,23,26)
InChIKeyKTAJIAXHIIKTAS-UHFFFAOYSA-N
XLogP28.76
TPSA386.55 Ų
H-Bond Donors6
H-Bond Acceptors30
Rotatable Bonds27
Heavy Atoms173
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002411.47
LogP ≤ 528.76
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1030

Analyze 2-chloro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2-chloro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide;2-fluoro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide with MolForge

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Launch Full Analysis

Related Compounds

N-[6-amino-3-bromo-5-(5-bromo-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-bromo-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-chloro-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3,6-dimethoxypyridazin-4-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(6-methoxy-4-methyl-3-pyridinyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;tert-butyl N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]carbamate
CID 157140544
N-[6-amino-3-bromo-5-(2-bromo-4-methylthiophen-3-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2-chloro-4-methylthiophen-3-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-2-chlorobenzamide;N-[5-amino-6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-3-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-(trifluoromethoxy)phenyl]-2-pyridinyl]-4-methylbenzamide;N-[6-formamido-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-4-methylbenzamide;4-methyl-N-[6-(methylamino)-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide
CID 157160116
N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-3-chloro-1-benzothiophene-2-carboxamide;N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-3-chloro-2-fluorobenzamide;N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-3-chloro-2-fluoro-4-methylbenzamide;N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-2,5-difluoro-3-methoxy-4-methylbenzamide;N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-2-fluoro-5-methylbenzamide;N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-3-fluoro-5-methylbenzamide
CID 157811475
CID 157871199
CID 157871199
N-[6-amino-5-(5-chlorothiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3,6-dimethoxypyridazin-4-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(6-methoxy-4-methyl-3-pyridinyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-4-methylbenzamide
CID 158343724
N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-2-chlorobenzamide;N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-2-chloro-4-methoxybenzamide;N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-3-methylbenzamide;N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-4-methylbenzamide;1-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-2-(3-methylphenyl)ethanone;N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-4-methyl-1,3-thiazole-5-carboxamide;methane
CID 158641118
N-[6-amino-5-(5-bromo-3-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-chlorothiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3,6-dimethoxypyridazin-4-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(6-methoxy-4-methyl-3-pyridinyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(5-methylthiophen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide
CID 158758319
N-[6-amino-3-bromo-5-(2-bromo-4-methylthiophen-3-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2-bromo-4-methylthiophen-3-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2-chloro-4-methylthiophen-3-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-2-chlorobenzamide;N-[5-amino-6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-3-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-(trifluoromethoxy)phenyl]-2-pyridinyl]-4-methylbenzamide;4-methyl-N-[6-(methylamino)-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide
CID 159609349
CID 159638110
CID 159638110
2,6-difluoro-N-[5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]pyrazin-2-yl]benzamide;2,6-difluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)pyrazin-2-yl]benzamide;2,6-difluoro-N-[6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide
CID 159749631
N-[6-amino-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-2-chlorobenzamide;N-[5-amino-6-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-3-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-(trifluoromethoxy)phenyl]-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(1,3,5-trimethylpyrazol-4-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-formamido-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]-4-methylbenzamide;4-methyl-N-[6-(methylamino)-5-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]-2-pyridinyl]benzamide
CID 160033376
7-N-[(5-acetylthiophen-2-yl)methyl]-5-N-[(3-chloro-4-fluorophenyl)methyl]-3-fluoropyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(5-acetylthiophen-2-yl)methyl]-5-N-[[3-(difluoromethoxy)-4-fluorophenyl]methyl]-3-fluoropyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(5-acetylthiophen-2-yl)methyl]-5-N-[[3-(difluoromethoxy)phenyl]methyl]-3-fluoropyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(5-acetylthiophen-2-yl)methyl]-5-N-[(3,4-difluorophenyl)methyl]-3-fluoropyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(5-acetylthiophen-2-yl)methyl]-3-fluoro-5-N-[[4-fluoro-3-(trifluoromethoxy)phenyl]methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide;7-N-[(5-acetylthiophen-2-yl)methyl]-3-fluoro-5-N-[[3-(trifluoromethoxy)phenyl]methyl]pyrazolo[1,5-a]pyrimidine-5,7-dicarboxamide
CID 160069943

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2-chloro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide;2-fluoro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide?
The IUPAC name of 2-chloro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2-chloro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide;2-fluoro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide (CID 159232062) is 2-chloro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2-chloro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide;2-fluoro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide.
What is the SMILES notation for 2-chloro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2-chloro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide;2-fluoro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide?
The canonical SMILES for 2-chloro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2-chloro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide;2-fluoro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide is COc1cccc(-c2cc(-c3ccc(NC(=O)c4c(F)cccc4F)nc3)n(C)n2)c1.COc1cccc(-c2cc(-c3ccc(NC(=O)c4ccccc4Cl)nc3)n(C)n2)c1.COc1cccc(-c2cc(-c3ccc(NC(=O)c4ccccc4F)nc3)n(C)n2)c1.Cn1nc(-c2cccs2)cc1-c1ccc(NC(=O)c2c(F)cccc2F)nc1.Cn1nc(-c2cccs2)cc1-c1ccc(NC(=O)c2ccccc2Cl)nc1.Cn1nc(-c2cccs2)cc1-c1ccc(NC(=O)c2ccccc2F)nc1.
What is the InChIKey of 2-chloro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2-chloro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide;2-fluoro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide?
The InChIKey is KTAJIAXHIIKTAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19ClN4O2.C23H18F2N4O2.C23H19FN4O2.C20H15ClN4OS.C20H14F2N4OS.C20H15FN4OS/c1-28-21(13-20(27-28)15-6-5-7-17(12-15)30-2)16-10-11-22(25-14-16)26-23(29)18-8-3-4-9-19(18)24;1-29-20(12-19(28-29)14-5-3-6-16(11-14)31-2)15-9-10-21(26-13-15)27-23(30)22-17(24)7-4-8-18(22)25;1-28-21(13-20(27-28)15-6-5-7-17(12-15)30-2)16-10-11-22(25-14-16)26-23(29)18-8-3-4-9-19(18)24;1-25-17(11-16(24-25)18-7-4-10-27-18)13-8-9-19(22-12-13)23-20(26)14-5-2-3-6-15(14)21;1-26-16(10-15(25-26)17-6-3-9-28-17)12-7-8-18(23-11-12)24-20(27)19-13(21)4-2-5-14(19)22;1-25-17(11-16(24-25)18-7-4-10-27-18)13-8-9-19(22-12-13)23-20(26)14-5-2-3-6-15(14)21/h3-14H,1-2H3,(H,25,26,29);3-13H,1-2H3,(H,26,27,30);3-14H,1-2H3,(H,25,26,29);2-12H,1H3,(H,22,23,26);2-11H,1H3,(H,23,24,27);2-12H,1H3,(H,22,23,26).
What are the key properties of 2-chloro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2-chloro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide;2-fluoro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide?
2-chloro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2-chloro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide;2-fluoro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide has a molecular weight of 2411.47 g/mol, XLogP of 28.76, 27 rotatable bonds, 6 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2-chloro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide;2,6-difluoro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2,6-difluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide;2-fluoro-N-[5-[3-(3-methoxyphenyl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide;2-fluoro-N-[5-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)-2-pyridinyl]benzamide is sourced from PubChem (CID 159232062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).