2-(2-methoxyphenyl)-1H-benzimidazole-4-carboxamide

C15H13N3O2 — CID 10801775

IUPAC2-(2-methoxyphenyl)-1H-benzimidazole-4-carboxamide
SMILESCOc1ccccc1-c1nc2c(C(N)=O)cccc2[nH]1
InChIInChI=1S/C15H13N3O2/c1-20-12-8-3-2-5-9(12)15-17-11-7-4-6-10(14(16)19)13(11)18-15/h2-8H,1H3,(H2,16,19)(H,17,18)
InChIKeyOAUAMWRHVIYHEU-UHFFFAOYSA-N
MW267.29 g/mol
LogP2.34
Rot. Bonds3

About 2-(2-methoxyphenyl)-1H-benzimidazole-4-carboxamide

2-(2-methoxyphenyl)-1H-benzimidazole-4-carboxamide (PubChem CID 10801775) has the molecular formula C15H13N3O2 and a molecular weight of 267.29 g/mol. Its IUPAC name is 2-(2-methoxyphenyl)-1H-benzimidazole-4-carboxamide.

Molecular Properties

Compound Name2-(2-methoxyphenyl)-1H-benzimidazole-4-carboxamide
PubChem CID10801775
Molecular FormulaC15H13N3O2
Molecular Weight267.29 g/mol
Exact Mass267.10
IUPAC Name2-(2-methoxyphenyl)-1H-benzimidazole-4-carboxamide
SMILESCOc1ccccc1-c1nc2c(C(N)=O)cccc2[nH]1
InChIInChI=1S/C15H13N3O2/c1-20-12-8-3-2-5-9(12)15-17-11-7-4-6-10(14(16)19)13(11)18-15/h2-8H,1H3,(H2,16,19)(H,17,18)
InChIKeyOAUAMWRHVIYHEU-UHFFFAOYSA-N
XLogP2.34
TPSA81.00 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenyl)-1H-benzimidazole-4-carboxamide?
The IUPAC name of 2-(2-methoxyphenyl)-1H-benzimidazole-4-carboxamide (CID 10801775) is 2-(2-methoxyphenyl)-1H-benzimidazole-4-carboxamide.
What is the SMILES notation for 2-(2-methoxyphenyl)-1H-benzimidazole-4-carboxamide?
The canonical SMILES for 2-(2-methoxyphenyl)-1H-benzimidazole-4-carboxamide is COc1ccccc1-c1nc2c(C(N)=O)cccc2[nH]1.
What is the InChIKey of 2-(2-methoxyphenyl)-1H-benzimidazole-4-carboxamide?
The InChIKey is OAUAMWRHVIYHEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O2/c1-20-12-8-3-2-5-9(12)15-17-11-7-4-6-10(14(16)19)13(11)18-15/h2-8H,1H3,(H2,16,19)(H,17,18).
What are the key properties of 2-(2-methoxyphenyl)-1H-benzimidazole-4-carboxamide?
2-(2-methoxyphenyl)-1H-benzimidazole-4-carboxamide has a molecular weight of 267.29 g/mol, XLogP of 2.34, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenyl)-1H-benzimidazole-4-carboxamide is sourced from PubChem (CID 10801775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).