4-methyl-6-(1-methylbenzimidazol-2-yl)pyridine-2-carboxylic acid

C15H13N3O2 — CID 134595074

IUPAC4-methyl-6-(1-methylbenzimidazol-2-yl)pyridine-2-carboxylic acid
SMILESCc1cc(C(=O)O)nc(-c2nc3ccccc3n2C)c1
InChIInChI=1S/C15H13N3O2/c1-9-7-11(16-12(8-9)15(19)20)14-17-10-5-3-4-6-13(10)18(14)2/h3-8H,1-2H3,(H,19,20)
InChIKeyFGIGEQYARJQLGR-UHFFFAOYSA-N
MW267.29 g/mol
LogP2.64
Rot. Bonds2

About 4-methyl-6-(1-methylbenzimidazol-2-yl)pyridine-2-carboxylic acid

4-methyl-6-(1-methylbenzimidazol-2-yl)pyridine-2-carboxylic acid (PubChem CID 134595074) has the molecular formula C15H13N3O2 and a molecular weight of 267.29 g/mol. Its IUPAC name is 4-methyl-6-(1-methylbenzimidazol-2-yl)pyridine-2-carboxylic acid.

Molecular Properties

Compound Name4-methyl-6-(1-methylbenzimidazol-2-yl)pyridine-2-carboxylic acid
PubChem CID134595074
Molecular FormulaC15H13N3O2
Molecular Weight267.29 g/mol
Exact Mass267.10
IUPAC Name4-methyl-6-(1-methylbenzimidazol-2-yl)pyridine-2-carboxylic acid
SMILESCc1cc(C(=O)O)nc(-c2nc3ccccc3n2C)c1
InChIInChI=1S/C15H13N3O2/c1-9-7-11(16-12(8-9)15(19)20)14-17-10-5-3-4-6-13(10)18(14)2/h3-8H,1-2H3,(H,19,20)
InChIKeyFGIGEQYARJQLGR-UHFFFAOYSA-N
XLogP2.64
TPSA68.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-methyl-2-[6-(1-methylbenzimidazol-2-yl)-4-phenyl-2-pyridinyl]benzimidazole
CID 15804948
2-ethyl-6-(1-methylbenzimidazol-2-yl)pyridine-3-carboxylic acid
CID 116532988
8-methyl-2-(1-methylbenzimidazol-2-yl)-5-[(1S)-1-phenylethoxy]quinoline-4-carboxylic acid
CID 129027681
1-[4-(1-methylbenzimidazol-2-yl)-1,3-thiazol-2-yl]ethanone
CID 63379627
1-methyl-2-(6-methyl-2-pyridinyl)benzimidazole
CID 71344812
1-methyl-2-pyridin-2-ylbenzimidazole-5-carboxylic acid
CID 63892433
2-(1-methylbenzimidazol-2-yl)phenol
CID 139198195
N-(3,5-dimethylphenyl)-5-(1-methylbenzimidazol-2-yl)thiophene-2-carboxamide
CID 4731697
N-(2,6-dimethylphenyl)-1-[6-(1-methylbenzimidazol-2-yl)-2-pyridinyl]ethanimine
CID 51050722
3-[4-(1-methylbenzimidazol-2-yl)phenoxy]propanoic acid
CID 167855437
7-chloro-2-(1-methylbenzimidazol-2-yl)-4-phenylquinoline
CID 100818108
4-(1-methylbenzimidazol-2-yl)-1,3-thiazol-2-amine
CID 16789350

Frequently Asked Questions

What is the IUPAC name of 4-methyl-6-(1-methylbenzimidazol-2-yl)pyridine-2-carboxylic acid?
The IUPAC name of 4-methyl-6-(1-methylbenzimidazol-2-yl)pyridine-2-carboxylic acid (CID 134595074) is 4-methyl-6-(1-methylbenzimidazol-2-yl)pyridine-2-carboxylic acid.
What is the SMILES notation for 4-methyl-6-(1-methylbenzimidazol-2-yl)pyridine-2-carboxylic acid?
The canonical SMILES for 4-methyl-6-(1-methylbenzimidazol-2-yl)pyridine-2-carboxylic acid is Cc1cc(C(=O)O)nc(-c2nc3ccccc3n2C)c1.
What is the InChIKey of 4-methyl-6-(1-methylbenzimidazol-2-yl)pyridine-2-carboxylic acid?
The InChIKey is FGIGEQYARJQLGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O2/c1-9-7-11(16-12(8-9)15(19)20)14-17-10-5-3-4-6-13(10)18(14)2/h3-8H,1-2H3,(H,19,20).
What are the key properties of 4-methyl-6-(1-methylbenzimidazol-2-yl)pyridine-2-carboxylic acid?
4-methyl-6-(1-methylbenzimidazol-2-yl)pyridine-2-carboxylic acid has a molecular weight of 267.29 g/mol, XLogP of 2.64, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-6-(1-methylbenzimidazol-2-yl)pyridine-2-carboxylic acid is sourced from PubChem (CID 134595074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).