N-(6-methyl-2-pyridinyl)-1H-benzimidazole-2-carboxamide

C14H12N4O — CID 14371315

IUPACN-(6-methyl-2-pyridinyl)-1H-benzimidazole-2-carboxamide
SMILESCc1cccc(NC(=O)c2nc3ccccc3[nH]2)n1
InChIInChI=1S/C14H12N4O/c1-9-5-4-8-12(15-9)18-14(19)13-16-10-6-2-3-7-11(10)17-13/h2-8H,1H3,(H,16,17)(H,15,18,19)
InChIKeyOJOWQQLEDYLHGC-UHFFFAOYSA-N
MW252.28 g/mol
LogP2.52
Rot. Bonds2

About N-(6-methyl-2-pyridinyl)-1H-benzimidazole-2-carboxamide

N-(6-methyl-2-pyridinyl)-1H-benzimidazole-2-carboxamide (PubChem CID 14371315) has the molecular formula C14H12N4O and a molecular weight of 252.28 g/mol. Its IUPAC name is N-(6-methyl-2-pyridinyl)-1H-benzimidazole-2-carboxamide.

Molecular Properties

Compound NameN-(6-methyl-2-pyridinyl)-1H-benzimidazole-2-carboxamide
PubChem CID14371315
Molecular FormulaC14H12N4O
Molecular Weight252.28 g/mol
Exact Mass252.10
IUPAC NameN-(6-methyl-2-pyridinyl)-1H-benzimidazole-2-carboxamide
SMILESCc1cccc(NC(=O)c2nc3ccccc3[nH]2)n1
InChIInChI=1S/C14H12N4O/c1-9-5-4-8-12(15-9)18-14(19)13-16-10-6-2-3-7-11(10)17-13/h2-8H,1H3,(H,16,17)(H,15,18,19)
InChIKeyOJOWQQLEDYLHGC-UHFFFAOYSA-N
XLogP2.52
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.28
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1H-benzimidazol-2-yl)-1H-benzimidazole-2-carboxamide
CID 12620222
N-pyrazin-2-yl-1H-benzimidazole-2-carboxamide
CID 14371322
N-hydroxy-1H-benzimidazole-2-carboxamide
CID 21114230
N-(4-hydroxy-2-methylphenyl)-1H-benzimidazole-2-carboxamide
CID 110468789
N-(3-acetylphenyl)-1H-benzimidazole-2-carboxamide
CID 110468819
2-acetamido-N-(6-methyl-2-pyridinyl)benzamide
CID 3354177
N-(4-carbamoylphenyl)-1H-benzimidazole-2-carboxamide
CID 110468823
2-(2-methyl-1H-indol-3-yl)-N-(6-methyl-2-pyridinyl)acetamide
CID 31903883
1H-benzimidazole-2-carbothioic S-acid
CID 19781386
1H-benzimidazole-2-carboxylic acid;cadmium
CID 174957595
3-methyl-N-(6-methyl-2-pyridinyl)benzamide
CID 966005
2-(carbamothioylamino)-N-(6-methyl-2-pyridinyl)benzamide
CID 169359188

Frequently Asked Questions

What is the IUPAC name of N-(6-methyl-2-pyridinyl)-1H-benzimidazole-2-carboxamide?
The IUPAC name of N-(6-methyl-2-pyridinyl)-1H-benzimidazole-2-carboxamide (CID 14371315) is N-(6-methyl-2-pyridinyl)-1H-benzimidazole-2-carboxamide.
What is the SMILES notation for N-(6-methyl-2-pyridinyl)-1H-benzimidazole-2-carboxamide?
The canonical SMILES for N-(6-methyl-2-pyridinyl)-1H-benzimidazole-2-carboxamide is Cc1cccc(NC(=O)c2nc3ccccc3[nH]2)n1.
What is the InChIKey of N-(6-methyl-2-pyridinyl)-1H-benzimidazole-2-carboxamide?
The InChIKey is OJOWQQLEDYLHGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N4O/c1-9-5-4-8-12(15-9)18-14(19)13-16-10-6-2-3-7-11(10)17-13/h2-8H,1H3,(H,16,17)(H,15,18,19).
What are the key properties of N-(6-methyl-2-pyridinyl)-1H-benzimidazole-2-carboxamide?
N-(6-methyl-2-pyridinyl)-1H-benzimidazole-2-carboxamide has a molecular weight of 252.28 g/mol, XLogP of 2.52, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methyl-2-pyridinyl)-1H-benzimidazole-2-carboxamide is sourced from PubChem (CID 14371315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).