(1-methylbenzimidazol-2-yl)-phenylmethanone

C15H12N2O — CID 677925

IUPAC(1-methylbenzimidazol-2-yl)-phenylmethanone
SMILESCn1c(C(=O)c2ccccc2)nc2ccccc21
InChIInChI=1S/C15H12N2O/c1-17-13-10-6-5-9-12(13)16-15(17)14(18)11-7-3-2-4-8-11/h2-10H,1H3
InChIKeyQFUHUTCCVCLTIX-UHFFFAOYSA-N
MW236.27 g/mol
LogP2.80
Rot. Bonds2

About (1-methylbenzimidazol-2-yl)-phenylmethanone

(1-methylbenzimidazol-2-yl)-phenylmethanone (PubChem CID 677925) has the molecular formula C15H12N2O and a molecular weight of 236.27 g/mol. Its IUPAC name is (1-methylbenzimidazol-2-yl)-phenylmethanone.

Molecular Properties

Compound Name(1-methylbenzimidazol-2-yl)-phenylmethanone
PubChem CID677925
Molecular FormulaC15H12N2O
Molecular Weight236.27 g/mol
Exact Mass236.09
IUPAC Name(1-methylbenzimidazol-2-yl)-phenylmethanone
SMILESCn1c(C(=O)c2ccccc2)nc2ccccc21
InChIInChI=1S/C15H12N2O/c1-17-13-10-6-5-9-12(13)16-15(17)14(18)11-7-3-2-4-8-11/h2-10H,1H3
InChIKeyQFUHUTCCVCLTIX-UHFFFAOYSA-N
XLogP2.80
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 52.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (1-methylbenzimidazol-2-yl)-phenylmethanone?
The IUPAC name of (1-methylbenzimidazol-2-yl)-phenylmethanone (CID 677925) is (1-methylbenzimidazol-2-yl)-phenylmethanone.
What is the SMILES notation for (1-methylbenzimidazol-2-yl)-phenylmethanone?
The canonical SMILES for (1-methylbenzimidazol-2-yl)-phenylmethanone is Cn1c(C(=O)c2ccccc2)nc2ccccc21.
What is the InChIKey of (1-methylbenzimidazol-2-yl)-phenylmethanone?
The InChIKey is QFUHUTCCVCLTIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O/c1-17-13-10-6-5-9-12(13)16-15(17)14(18)11-7-3-2-4-8-11/h2-10H,1H3.
What are the key properties of (1-methylbenzimidazol-2-yl)-phenylmethanone?
(1-methylbenzimidazol-2-yl)-phenylmethanone has a molecular weight of 236.27 g/mol, XLogP of 2.80, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methylbenzimidazol-2-yl)-phenylmethanone is sourced from PubChem (CID 677925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).