5-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1-methylbenzimidazole;6-[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;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]imidazo[1,2-a]pyridine;5-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]-1H-pyrazolo[3,4-b]pyridine

C123H96F7N21O — CID 158196289

IUPAC5-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1-methylbenzimidazole;6-[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;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]imidazo[1,2-a]pyridine;5-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]-1H-pyrazolo[3,4-b]pyridine
SMILESCc1cc(-c2ncccc2-c2cc(C(=O)N(C)C)c3[nH]ncc3c2)ccc1F.Cn1cnc2cc(-c3cccnc3-c3cccc(C4CC4)c3)ccc21.Cn1cnc2ccc(-c3cccnc3-c3cccc(C4CC4)c3)cc21.FC(F)(F)c1cccc(-c2ncccc2-c2ccc3nccn3c2)c1.FC(F)(F)c1cccc(-c2ncccc2-c2cnc3[nH]ncc3c2)c1.c1cc(-c2ncccc2-c2ccc3ncnn3c2)cc(C2CC2)c1
InChIInChI=1S/C22H19FN4O.2C22H19N3.C20H16N4.C19H12F3N3.C18H11F3N4/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;1-25-14-24-20-10-9-17(13-21(20)25)19-6-3-11-23-22(19)18-5-2-4-16(12-18)15-7-8-15;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;20-19(21,22)15-4-1-3-13(11-15)18-16(5-2-8-24-18)14-6-7-17-23-9-10-25(17)12-14;19-18(20,21)14-4-1-3-11(8-14)16-15(5-2-6-22-16)12-7-13-10-24-25-17(13)23-9-12/h4-12H,1-3H3,(H,25,26);2*2-6,9-15H,7-8H2,1H3;1-5,8-14H,6-7H2;1-12H;1-10H,(H,23,24,25)
InChIKeyGAJKJVXOQWWOBN-UHFFFAOYSA-N
MW2017.25 g/mol
LogP28.92
Rot. Bonds16

About 5-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1-methylbenzimidazole;6-[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;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]imidazo[1,2-a]pyridine;5-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]-1H-pyrazolo[3,4-b]pyridine

5-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1-methylbenzimidazole;6-[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;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]imidazo[1,2-a]pyridine;5-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]-1H-pyrazolo[3,4-b]pyridine (PubChem CID 158196289) has the molecular formula C123H96F7N21O and a molecular weight of 2017.25 g/mol. Its IUPAC name is 5-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1-methylbenzimidazole;6-[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;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]imidazo[1,2-a]pyridine;5-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]-1H-pyrazolo[3,4-b]pyridine.

Molecular Properties

Compound Name5-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1-methylbenzimidazole;6-[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;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]imidazo[1,2-a]pyridine;5-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]-1H-pyrazolo[3,4-b]pyridine
PubChem CID158196289
Molecular FormulaC123H96F7N21O
Molecular Weight2017.25 g/mol
Exact Mass2015.80
IUPAC Name5-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1-methylbenzimidazole;6-[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;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]imidazo[1,2-a]pyridine;5-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]-1H-pyrazolo[3,4-b]pyridine
SMILESCc1cc(-c2ncccc2-c2cc(C(=O)N(C)C)c3[nH]ncc3c2)ccc1F.Cn1cnc2cc(-c3cccnc3-c3cccc(C4CC4)c3)ccc21.Cn1cnc2ccc(-c3cccnc3-c3cccc(C4CC4)c3)cc21.FC(F)(F)c1cccc(-c2ncccc2-c2ccc3nccn3c2)c1.FC(F)(F)c1cccc(-c2ncccc2-c2cnc3[nH]ncc3c2)c1.c1cc(-c2ncccc2-c2ccc3ncnn3c2)cc(C2CC2)c1
InChIInChI=1S/C22H19FN4O.2C22H19N3.C20H16N4.C19H12F3N3.C18H11F3N4/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;1-25-14-24-20-10-9-17(13-21(20)25)19-6-3-11-23-22(19)18-5-2-4-16(12-18)15-7-8-15;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;20-19(21,22)15-4-1-3-13(11-15)18-16(5-2-8-24-18)14-6-7-17-23-9-10-25(17)12-14;19-18(20,21)14-4-1-3-11(8-14)16-15(5-2-6-22-16)12-7-13-10-24-25-17(13)23-9-12/h4-12H,1-3H3,(H,25,26);2*2-6,9-15H,7-8H2,1H3;1-5,8-14H,6-7H2;1-12H;1-10H,(H,23,24,25)
InChIKeyGAJKJVXOQWWOBN-UHFFFAOYSA-N
XLogP28.92
TPSA251.03 Ų
H-Bond Donors2
H-Bond Acceptors19
Rotatable Bonds16
Heavy Atoms152
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002017.25
LogP ≤ 528.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1019

Analyze 5-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1-methylbenzimidazole;6-[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;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]imidazo[1,2-a]pyridine;5-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]-1H-pyrazolo[3,4-b]pyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1-methylbenzimidazole;6-[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;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]imidazo[1,2-a]pyridine;5-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]-1H-pyrazolo[3,4-b]pyridine?
The IUPAC name of 5-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1-methylbenzimidazole;6-[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;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]imidazo[1,2-a]pyridine;5-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]-1H-pyrazolo[3,4-b]pyridine (CID 158196289) is 5-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1-methylbenzimidazole;6-[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;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]imidazo[1,2-a]pyridine;5-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]-1H-pyrazolo[3,4-b]pyridine.
What is the SMILES notation for 5-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1-methylbenzimidazole;6-[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;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]imidazo[1,2-a]pyridine;5-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]-1H-pyrazolo[3,4-b]pyridine?
The canonical SMILES for 5-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1-methylbenzimidazole;6-[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;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]imidazo[1,2-a]pyridine;5-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]-1H-pyrazolo[3,4-b]pyridine is Cc1cc(-c2ncccc2-c2cc(C(=O)N(C)C)c3[nH]ncc3c2)ccc1F.Cn1cnc2cc(-c3cccnc3-c3cccc(C4CC4)c3)ccc21.Cn1cnc2ccc(-c3cccnc3-c3cccc(C4CC4)c3)cc21.FC(F)(F)c1cccc(-c2ncccc2-c2ccc3nccn3c2)c1.FC(F)(F)c1cccc(-c2ncccc2-c2cnc3[nH]ncc3c2)c1.c1cc(-c2ncccc2-c2ccc3ncnn3c2)cc(C2CC2)c1.
What is the InChIKey of 5-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1-methylbenzimidazole;6-[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;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]imidazo[1,2-a]pyridine;5-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]-1H-pyrazolo[3,4-b]pyridine?
The InChIKey is GAJKJVXOQWWOBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19FN4O.2C22H19N3.C20H16N4.C19H12F3N3.C18H11F3N4/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;1-25-14-24-20-10-9-17(13-21(20)25)19-6-3-11-23-22(19)18-5-2-4-16(12-18)15-7-8-15;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;20-19(21,22)15-4-1-3-13(11-15)18-16(5-2-8-24-18)14-6-7-17-23-9-10-25(17)12-14;19-18(20,21)14-4-1-3-11(8-14)16-15(5-2-6-22-16)12-7-13-10-24-25-17(13)23-9-12/h4-12H,1-3H3,(H,25,26);2*2-6,9-15H,7-8H2,1H3;1-5,8-14H,6-7H2;1-12H;1-10H,(H,23,24,25).
What are the key properties of 5-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1-methylbenzimidazole;6-[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;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]imidazo[1,2-a]pyridine;5-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]-1H-pyrazolo[3,4-b]pyridine?
5-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1-methylbenzimidazole;6-[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;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]imidazo[1,2-a]pyridine;5-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]-1H-pyrazolo[3,4-b]pyridine has a molecular weight of 2017.25 g/mol, XLogP of 28.92, 16 rotatable bonds, 2 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(3-cyclopropylphenyl)-3-pyridinyl]-1-methylbenzimidazole;6-[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;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]imidazo[1,2-a]pyridine;5-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]-1H-pyrazolo[3,4-b]pyridine is sourced from PubChem (CID 158196289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).