2-(2-ethylbenzimidazol-1-yl)-1-(2-methylphenyl)ethanone

C18H18N2O — CID 60975590

IUPAC2-(2-ethylbenzimidazol-1-yl)-1-(2-methylphenyl)ethanone
SMILESCCc1nc2ccccc2n1CC(=O)c1ccccc1C
InChIInChI=1S/C18H18N2O/c1-3-18-19-15-10-6-7-11-16(15)20(18)12-17(21)14-9-5-4-8-13(14)2/h4-11H,3,12H2,1-2H3
InChIKeyDKODPLOUMUJGPG-UHFFFAOYSA-N
MW278.36 g/mol
LogP3.79
Rot. Bonds4

About 2-(2-ethylbenzimidazol-1-yl)-1-(2-methylphenyl)ethanone

2-(2-ethylbenzimidazol-1-yl)-1-(2-methylphenyl)ethanone (PubChem CID 60975590) has the molecular formula C18H18N2O and a molecular weight of 278.36 g/mol. Its IUPAC name is 2-(2-ethylbenzimidazol-1-yl)-1-(2-methylphenyl)ethanone.

Molecular Properties

Compound Name2-(2-ethylbenzimidazol-1-yl)-1-(2-methylphenyl)ethanone
PubChem CID60975590
Molecular FormulaC18H18N2O
Molecular Weight278.36 g/mol
Exact Mass278.14
IUPAC Name2-(2-ethylbenzimidazol-1-yl)-1-(2-methylphenyl)ethanone
SMILESCCc1nc2ccccc2n1CC(=O)c1ccccc1C
InChIInChI=1S/C18H18N2O/c1-3-18-19-15-10-6-7-11-16(15)20(18)12-17(21)14-9-5-4-8-13(14)2/h4-11H,3,12H2,1-2H3
InChIKeyDKODPLOUMUJGPG-UHFFFAOYSA-N
XLogP3.79
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-ethylbenzimidazol-1-yl)-N,N-di(propan-2-yl)acetamide
CID 16996472
N-butyl-2-(2-ethylbenzimidazol-1-yl)-N-methylacetamide
CID 16996476
N-[[1-(2-amino-2-oxoethyl)benzimidazol-2-yl]methyl]-2-methylbenzamide
CID 17029387
ethyl 2-[2-[[(2-methylbenzoyl)amino]methyl]benzimidazol-1-yl]acetate
CID 17006923
2-[(2-ethylbenzimidazol-1-yl)methyl]benzamide
CID 116622514
1-(3-bromothiophen-2-yl)-2-(2-ethylbenzimidazol-1-yl)ethanone
CID 60778644
ethyl 2-[2-[2-[(2-methylbenzoyl)amino]ethyl]benzimidazol-1-yl]acetate
CID 16976016
2-(2-ethylbenzimidazol-1-yl)-N-(2-ethylphenyl)acetamide
CID 4789521
2-(2-ethylbenzimidazol-1-yl)-N-(2-methylbutan-2-yl)acetamide
CID 115572979
3-(2-ethylbenzimidazol-1-yl)propanoic acid chloride
CID 53347020
1,7-bis(2-ethylbenzimidazol-1-yl)heptan-4-one
CID 139073818
N-[[1-[2-[di(butan-2-yl)amino]-2-oxoethyl]benzimidazol-2-yl]methyl]-2-methylbenzamide
CID 17006928

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylbenzimidazol-1-yl)-1-(2-methylphenyl)ethanone?
The IUPAC name of 2-(2-ethylbenzimidazol-1-yl)-1-(2-methylphenyl)ethanone (CID 60975590) is 2-(2-ethylbenzimidazol-1-yl)-1-(2-methylphenyl)ethanone.
What is the SMILES notation for 2-(2-ethylbenzimidazol-1-yl)-1-(2-methylphenyl)ethanone?
The canonical SMILES for 2-(2-ethylbenzimidazol-1-yl)-1-(2-methylphenyl)ethanone is CCc1nc2ccccc2n1CC(=O)c1ccccc1C.
What is the InChIKey of 2-(2-ethylbenzimidazol-1-yl)-1-(2-methylphenyl)ethanone?
The InChIKey is DKODPLOUMUJGPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O/c1-3-18-19-15-10-6-7-11-16(15)20(18)12-17(21)14-9-5-4-8-13(14)2/h4-11H,3,12H2,1-2H3.
What are the key properties of 2-(2-ethylbenzimidazol-1-yl)-1-(2-methylphenyl)ethanone?
2-(2-ethylbenzimidazol-1-yl)-1-(2-methylphenyl)ethanone has a molecular weight of 278.36 g/mol, XLogP of 3.79, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylbenzimidazol-1-yl)-1-(2-methylphenyl)ethanone is sourced from PubChem (CID 60975590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).