N-methyl-N-(pyridin-2-ylmethyl)-3H-benzimidazole-5-carboxamide

C15H14N4O — CID 43582173

IUPACN-methyl-N-(pyridin-2-ylmethyl)-3H-benzimidazole-5-carboxamide
SMILESCN(Cc1ccccn1)C(=O)c1ccc2nc[nH]c2c1
InChIInChI=1S/C15H14N4O/c1-19(9-12-4-2-3-7-16-12)15(20)11-5-6-13-14(8-11)18-10-17-13/h2-8,10H,9H2,1H3,(H,17,18)
InChIKeyRNJUJDIFZJOJSE-UHFFFAOYSA-N
MW266.30 g/mol
LogP2.23
Rot. Bonds3

About N-methyl-N-(pyridin-2-ylmethyl)-3H-benzimidazole-5-carboxamide

N-methyl-N-(pyridin-2-ylmethyl)-3H-benzimidazole-5-carboxamide (PubChem CID 43582173) has the molecular formula C15H14N4O and a molecular weight of 266.30 g/mol. Its IUPAC name is N-methyl-N-(pyridin-2-ylmethyl)-3H-benzimidazole-5-carboxamide.

Molecular Properties

Compound NameN-methyl-N-(pyridin-2-ylmethyl)-3H-benzimidazole-5-carboxamide
PubChem CID43582173
Molecular FormulaC15H14N4O
Molecular Weight266.30 g/mol
Exact Mass266.12
IUPAC NameN-methyl-N-(pyridin-2-ylmethyl)-3H-benzimidazole-5-carboxamide
SMILESCN(Cc1ccccn1)C(=O)c1ccc2nc[nH]c2c1
InChIInChI=1S/C15H14N4O/c1-19(9-12-4-2-3-7-16-12)15(20)11-5-6-13-14(8-11)18-10-17-13/h2-8,10H,9H2,1H3,(H,17,18)
InChIKeyRNJUJDIFZJOJSE-UHFFFAOYSA-N
XLogP2.23
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-(1H-pyrazol-5-ylmethyl)-3H-benzimidazole-5-carboxamide
CID 29025706
N-methyl-N-(pyridin-3-ylmethyl)-3H-benzimidazole-5-carboxamide
CID 43397556
N-methyl-N-[(3-methylthiophen-2-yl)methyl]-3H-benzimidazole-5-carboxamide
CID 60651360
4-amino-N-methyl-N-(pyridin-2-ylmethyl)benzamide
CID 43564701
3-hydroxy-4-iodo-N-methyl-N-(pyridin-2-ylmethyl)benzamide
CID 104627774
4-fluoro-N,3-dimethyl-N-(pyridin-2-ylmethyl)benzamide
CID 63212311
N-methyl-N-[(2-methylcyclopropyl)methyl]-3H-benzimidazole-5-carboxamide
CID 63860629
N-[3-(2-ethylphenyl)-2-oxopropyl]-N-methyl-3H-benzimidazole-5-carboxamide
CID 160963880
N-methyl-N-propan-2-yl-3H-benzimidazole-5-carboxamide
CID 43420531
4-methoxy-N-methyl-3-pyridin-2-yl-N-(pyridin-2-ylmethyl)benzamide
CID 71909818
N-(3-amino-4-methylpentyl)-N-methyl-3H-benzimidazole-5-carboxamide
CID 115317434
N-methyl-N-(oxolan-2-ylmethyl)-3H-benzimidazole-5-carboxamide
CID 61433534

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(pyridin-2-ylmethyl)-3H-benzimidazole-5-carboxamide?
The IUPAC name of N-methyl-N-(pyridin-2-ylmethyl)-3H-benzimidazole-5-carboxamide (CID 43582173) is N-methyl-N-(pyridin-2-ylmethyl)-3H-benzimidazole-5-carboxamide.
What is the SMILES notation for N-methyl-N-(pyridin-2-ylmethyl)-3H-benzimidazole-5-carboxamide?
The canonical SMILES for N-methyl-N-(pyridin-2-ylmethyl)-3H-benzimidazole-5-carboxamide is CN(Cc1ccccn1)C(=O)c1ccc2nc[nH]c2c1.
What is the InChIKey of N-methyl-N-(pyridin-2-ylmethyl)-3H-benzimidazole-5-carboxamide?
The InChIKey is RNJUJDIFZJOJSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O/c1-19(9-12-4-2-3-7-16-12)15(20)11-5-6-13-14(8-11)18-10-17-13/h2-8,10H,9H2,1H3,(H,17,18).
What are the key properties of N-methyl-N-(pyridin-2-ylmethyl)-3H-benzimidazole-5-carboxamide?
N-methyl-N-(pyridin-2-ylmethyl)-3H-benzimidazole-5-carboxamide has a molecular weight of 266.30 g/mol, XLogP of 2.23, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(pyridin-2-ylmethyl)-3H-benzimidazole-5-carboxamide is sourced from PubChem (CID 43582173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).