6-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1H-benzimidazole;5-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1-methylbenzimidazole;6-[2-(3-cyclopropylphenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N,N-dimethyl-1H-indazole-7-carboxamide;1-methyl-6-[2-(3-propan-2-ylphenyl)-3-pyridinyl]benzimidazole

C107H92FN17O — CID 157322090

IUPAC6-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1H-benzimidazole;5-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1-methylbenzimidazole;6-[2-(3-cyclopropylphenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N,N-dimethyl-1H-indazole-7-carboxamide;1-methyl-6-[2-(3-propan-2-ylphenyl)-3-pyridinyl]benzimidazole
SMILESCC(C)c1cccc(-c2ncccc2-c2ccc3ncn(C)c3c2)c1.Cc1cc(-c2ncccc2-c2cc(C(=O)N(C)C)c3[nH]ncc3c2)ccc1F.Cn1cnc2cc(-c3cccnc3-c3cccc(C4CC4)c3)ccc21.c1cc(-c2ncccc2-c2ccc3nc[nH]c3c2)cc(C2CC2)c1.c1cc(-c2ncccc2-c2ccc3ncnn3c2)cc(C2CC2)c1
InChIInChI=1S/C22H19FN4O.C22H19N3.C22H21N3.C21H17N3.C20H16N4/c1-13-9-14(6-7-19(13)23)20-17(5-4-8-24-20)15-10-16-12-25-26-21(16)18(11-15)22(28)27(2)3;1-25-14-24-20-13-17(9-10-21(20)25)19-6-3-11-23-22(19)18-5-2-4-16(12-18)15-7-8-15;1-15(2)16-6-4-7-18(12-16)22-19(8-5-11-23-22)17-9-10-20-21(13-17)25(3)14-24-20;1-3-15(14-6-7-14)11-17(4-1)21-18(5-2-10-22-21)16-8-9-19-20(12-16)24-13-23-19;1-3-15(14-6-7-14)11-16(4-1)20-18(5-2-10-21-20)17-8-9-19-22-13-23-24(19)12-17/h4-12H,1-3H3,(H,25,26);2-6,9-15H,7-8H2,1H3;4-15H,1-3H3;1-5,8-14H,6-7H2,(H,23,24);1-5,8-14H,6-7H2
InChIKeyBEHCEGIHFPKNSO-UHFFFAOYSA-N
MW1651.03 g/mol
LogP24.55
Rot. Bonds15

About 6-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1H-benzimidazole;5-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1-methylbenzimidazole;6-[2-(3-cyclopropylphenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N,N-dimethyl-1H-indazole-7-carboxamide;1-methyl-6-[2-(3-propan-2-ylphenyl)-3-pyridinyl]benzimidazole

6-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1H-benzimidazole;5-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1-methylbenzimidazole;6-[2-(3-cyclopropylphenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N,N-dimethyl-1H-indazole-7-carboxamide;1-methyl-6-[2-(3-propan-2-ylphenyl)-3-pyridinyl]benzimidazole (PubChem CID 157322090) has the molecular formula C107H92FN17O and a molecular weight of 1651.03 g/mol. Its IUPAC name is 6-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1H-benzimidazole;5-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1-methylbenzimidazole;6-[2-(3-cyclopropylphenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N,N-dimethyl-1H-indazole-7-carboxamide;1-methyl-6-[2-(3-propan-2-ylphenyl)-3-pyridinyl]benzimidazole.

Molecular Properties

Compound Name6-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1H-benzimidazole;5-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1-methylbenzimidazole;6-[2-(3-cyclopropylphenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N,N-dimethyl-1H-indazole-7-carboxamide;1-methyl-6-[2-(3-propan-2-ylphenyl)-3-pyridinyl]benzimidazole
PubChem CID157322090
Molecular FormulaC107H92FN17O
Molecular Weight1651.03 g/mol
Exact Mass1649.77
IUPAC Name6-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1H-benzimidazole;5-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1-methylbenzimidazole;6-[2-(3-cyclopropylphenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N,N-dimethyl-1H-indazole-7-carboxamide;1-methyl-6-[2-(3-propan-2-ylphenyl)-3-pyridinyl]benzimidazole
SMILESCC(C)c1cccc(-c2ncccc2-c2ccc3ncn(C)c3c2)c1.Cc1cc(-c2ncccc2-c2cc(C(=O)N(C)C)c3[nH]ncc3c2)ccc1F.Cn1cnc2cc(-c3cccnc3-c3cccc(C4CC4)c3)ccc21.c1cc(-c2ncccc2-c2ccc3nc[nH]c3c2)cc(C2CC2)c1.c1cc(-c2ncccc2-c2ccc3ncnn3c2)cc(C2CC2)c1
InChIInChI=1S/C22H19FN4O.C22H19N3.C22H21N3.C21H17N3.C20H16N4/c1-13-9-14(6-7-19(13)23)20-17(5-4-8-24-20)15-10-16-12-25-26-21(16)18(11-15)22(28)27(2)3;1-25-14-24-20-13-17(9-10-21(20)25)19-6-3-11-23-22(19)18-5-2-4-16(12-18)15-7-8-15;1-15(2)16-6-4-7-18(12-16)22-19(8-5-11-23-22)17-9-10-20-21(13-17)25(3)14-24-20;1-3-15(14-6-7-14)11-17(4-1)21-18(5-2-10-22-21)16-8-9-19-20(12-16)24-13-23-19;1-3-15(14-6-7-14)11-16(4-1)20-18(5-2-10-21-20)17-8-9-19-22-13-23-24(19)12-17/h4-12H,1-3H3,(H,25,26);2-6,9-15H,7-8H2,1H3;4-15H,1-3H3;1-5,8-14H,6-7H2,(H,23,24);1-5,8-14H,6-7H2
InChIKeyBEHCEGIHFPKNSO-UHFFFAOYSA-N
XLogP24.55
TPSA207.95 Ų
H-Bond Donors2
H-Bond Acceptors15
Rotatable Bonds15
Heavy Atoms126
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001651.03
LogP ≤ 524.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1015

Analyze 6-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1H-benzimidazole;5-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1-methylbenzimidazole;6-[2-(3-cyclopropylphenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N,N-dimethyl-1H-indazole-7-carboxamide;1-methyl-6-[2-(3-propan-2-ylphenyl)-3-pyridinyl]benzimidazole with MolForge

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Related Compounds

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CID 156828749
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CID 156828976
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CID 156829011
US12473304, Example 322
CID 156829809
2-[[4-[3-[2-[[6-[3-[2-[(4-Amino-3-pyridin-3-ylpyrazolo[3,4-d]pyrimidin-1-yl)methyl]-5-methyl-4-oxopyrido[2,3-d]pyrimidin-3-yl]-2-methylanilino]purin-9-yl]methyl]-5-methyl-4-oxopyrido[2,3-d]pyrimidin-3-yl]-4-fluoroanilino]-3-cyclopropylpyrazolo[3,4-d]pyrimidin-1-yl]methyl]-5-methyl-3-(2-methylphenyl)pyrido[2,3-d]pyrimidin-4-one
CID 132146131
5-[7-(difluoromethyl)-3-[1-[5-[7-(difluoromethyl)-3-[1-[5-[7-(difluoromethyl)-6-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]-3-(methylcarbamoyl)-1H-indol-7-yl]ethyl]-6-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]-3-(methylcarbamoyl)-1H-pyrrolo[2,3-c]pyridin-7-yl]ethyl]-6-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]-N,7-dimethyl-1H-pyrrolo[2,3-c]pyridine-3-carboxamide
CID 132181501
3-[7-(difluoromethyl)-6-[1-[2-[[3-[6-[1-methyl-5-[[4-[2-[6-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]-5H-pyrrolo[2,3-b]pyrazin-7-yl]pyrazol-1-yl]methyl]pyrazol-4-yl]-3,4-dihydro-2H-quinolin-1-yl]-1-(oxan-4-yl)indazole-5-carbonyl]amino]ethyl]pyrazol-4-yl]-3,4-dihydro-2H-quinolin-1-yl]-N-methyl-1-(oxan-4-yl)indazole-5-carboxamide
CID 132181733
N-[5-[3-[7-[3-[2-(dimethylamino)ethylamino]-5-fluorophenyl]-3H-imidazo[4,5-c]pyridin-2-yl]-1H-pyrazolo[5,4-b]pyridin-5-yl]-3-pyridinyl]benzamide
CID 136495697
N-[5-[3-[4-[3-[2-(dimethylamino)ethylamino]-5-fluorophenyl]-1H-benzimidazol-2-yl]-1H-pyrazolo[5,4-b]pyridin-5-yl]-3-pyridinyl]benzamide
CID 136496039
N-[5-[3-[7-[3-[2-[[3-[7-[3-[2-(dimethylamino)ethylamino]-5-fluorophenyl]-3H-imidazo[4,5-c]pyridin-2-yl]-5-(4-methyl-3-pyridinyl)indazol-1-yl]-methylamino]ethylamino]-5-fluorophenyl]-2,3-dihydro-1H-imidazo[4,5-c]pyridin-2-yl]-2H-indazol-5-yl]-3-pyridinyl]-2,2-dimethylpropanamide
CID 136619701
N-[5-[3-[7-[3-[2-(dimethylamino)ethylamino]-5-fluorophenyl]-3H-imidazo[4,5-c]pyridin-2-yl]-1-[2-[3-fluoro-5-[2-[5-[5-(propan-2-ylamino)-3-pyridinyl]-1H-indazol-3-yl]-3H-imidazo[4,5-c]pyridin-7-yl]anilino]ethyl-methylamino]indazol-5-yl]-3-pyridinyl]-2-methylpropanamide
CID 136619702

Frequently Asked Questions

What is the IUPAC name of 6-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1H-benzimidazole;5-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1-methylbenzimidazole;6-[2-(3-cyclopropylphenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N,N-dimethyl-1H-indazole-7-carboxamide;1-methyl-6-[2-(3-propan-2-ylphenyl)-3-pyridinyl]benzimidazole?
The IUPAC name of 6-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1H-benzimidazole;5-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1-methylbenzimidazole;6-[2-(3-cyclopropylphenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N,N-dimethyl-1H-indazole-7-carboxamide;1-methyl-6-[2-(3-propan-2-ylphenyl)-3-pyridinyl]benzimidazole (CID 157322090) is 6-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1H-benzimidazole;5-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1-methylbenzimidazole;6-[2-(3-cyclopropylphenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N,N-dimethyl-1H-indazole-7-carboxamide;1-methyl-6-[2-(3-propan-2-ylphenyl)-3-pyridinyl]benzimidazole.
What is the SMILES notation for 6-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1H-benzimidazole;5-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1-methylbenzimidazole;6-[2-(3-cyclopropylphenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N,N-dimethyl-1H-indazole-7-carboxamide;1-methyl-6-[2-(3-propan-2-ylphenyl)-3-pyridinyl]benzimidazole?
The canonical SMILES for 6-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1H-benzimidazole;5-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1-methylbenzimidazole;6-[2-(3-cyclopropylphenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N,N-dimethyl-1H-indazole-7-carboxamide;1-methyl-6-[2-(3-propan-2-ylphenyl)-3-pyridinyl]benzimidazole is CC(C)c1cccc(-c2ncccc2-c2ccc3ncn(C)c3c2)c1.Cc1cc(-c2ncccc2-c2cc(C(=O)N(C)C)c3[nH]ncc3c2)ccc1F.Cn1cnc2cc(-c3cccnc3-c3cccc(C4CC4)c3)ccc21.c1cc(-c2ncccc2-c2ccc3nc[nH]c3c2)cc(C2CC2)c1.c1cc(-c2ncccc2-c2ccc3ncnn3c2)cc(C2CC2)c1.
What is the InChIKey of 6-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1H-benzimidazole;5-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1-methylbenzimidazole;6-[2-(3-cyclopropylphenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N,N-dimethyl-1H-indazole-7-carboxamide;1-methyl-6-[2-(3-propan-2-ylphenyl)-3-pyridinyl]benzimidazole?
The InChIKey is BEHCEGIHFPKNSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19FN4O.C22H19N3.C22H21N3.C21H17N3.C20H16N4/c1-13-9-14(6-7-19(13)23)20-17(5-4-8-24-20)15-10-16-12-25-26-21(16)18(11-15)22(28)27(2)3;1-25-14-24-20-13-17(9-10-21(20)25)19-6-3-11-23-22(19)18-5-2-4-16(12-18)15-7-8-15;1-15(2)16-6-4-7-18(12-16)22-19(8-5-11-23-22)17-9-10-20-21(13-17)25(3)14-24-20;1-3-15(14-6-7-14)11-17(4-1)21-18(5-2-10-22-21)16-8-9-19-20(12-16)24-13-23-19;1-3-15(14-6-7-14)11-16(4-1)20-18(5-2-10-21-20)17-8-9-19-22-13-23-24(19)12-17/h4-12H,1-3H3,(H,25,26);2-6,9-15H,7-8H2,1H3;4-15H,1-3H3;1-5,8-14H,6-7H2,(H,23,24);1-5,8-14H,6-7H2.
What are the key properties of 6-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1H-benzimidazole;5-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1-methylbenzimidazole;6-[2-(3-cyclopropylphenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N,N-dimethyl-1H-indazole-7-carboxamide;1-methyl-6-[2-(3-propan-2-ylphenyl)-3-pyridinyl]benzimidazole?
6-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1H-benzimidazole;5-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1-methylbenzimidazole;6-[2-(3-cyclopropylphenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N,N-dimethyl-1H-indazole-7-carboxamide;1-methyl-6-[2-(3-propan-2-ylphenyl)-3-pyridinyl]benzimidazole has a molecular weight of 1651.03 g/mol, XLogP of 24.55, 15 rotatable bonds, 2 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1H-benzimidazole;5-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1-methylbenzimidazole;6-[2-(3-cyclopropylphenyl)-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyridine;5-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]-N,N-dimethyl-1H-indazole-7-carboxamide;1-methyl-6-[2-(3-propan-2-ylphenyl)-3-pyridinyl]benzimidazole is sourced from PubChem (CID 157322090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).