2-(3-methyl-2-oxobenzimidazol-1-yl)-N-(2-methylphenyl)acetamide

C17H17N3O2 — CID 664058

IUPAC2-(3-methyl-2-oxobenzimidazol-1-yl)-N-(2-methylphenyl)acetamide
SMILESCc1ccccc1NC(=O)Cn1c(=O)n(C)c2ccccc21
InChIInChI=1S/C17H17N3O2/c1-12-7-3-4-8-13(12)18-16(21)11-20-15-10-6-5-9-14(15)19(2)17(20)22/h3-10H,11H2,1-2H3,(H,18,21)
InChIKeyNCMFYCSLSXUGGQ-UHFFFAOYSA-N
MW295.34 g/mol
LogP2.29
Rot. Bonds3

About 2-(3-methyl-2-oxobenzimidazol-1-yl)-N-(2-methylphenyl)acetamide

2-(3-methyl-2-oxobenzimidazol-1-yl)-N-(2-methylphenyl)acetamide (PubChem CID 664058) has the molecular formula C17H17N3O2 and a molecular weight of 295.34 g/mol. Its IUPAC name is 2-(3-methyl-2-oxobenzimidazol-1-yl)-N-(2-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(3-methyl-2-oxobenzimidazol-1-yl)-N-(2-methylphenyl)acetamide
PubChem CID664058
Molecular FormulaC17H17N3O2
Molecular Weight295.34 g/mol
Exact Mass295.13
IUPAC Name2-(3-methyl-2-oxobenzimidazol-1-yl)-N-(2-methylphenyl)acetamide
SMILESCc1ccccc1NC(=O)Cn1c(=O)n(C)c2ccccc21
InChIInChI=1S/C17H17N3O2/c1-12-7-3-4-8-13(12)18-16(21)11-20-15-10-6-5-9-14(15)19(2)17(20)22/h3-10H,11H2,1-2H3,(H,18,21)
InChIKeyNCMFYCSLSXUGGQ-UHFFFAOYSA-N
XLogP2.29
TPSA56.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.34
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 4615
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CID 132955
1,3-Dihydro-1-(1,2,3,6-tetrahydro-1-(phenylmethyl)-4-pyridinyl)-2H-benzimidazol-2-one
CID 96482
3-{2-[Ethyl(3-methylphenyl)amino]ethyl}-1-(2-methylphenyl)urea
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2H-Benzimidazol-2-one, 1,3-dihydro-1-(phenylmethyl)-4-(1-piperazinyl)-
CID 11587610
2-(2,5-dioxoimidazolidin-1-yl)-N-(p-tolyl)acetamide
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N-(5-fluoro-2-methylphenyl)-2-methyl-4-oxo-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine-1-carboxamide
CID 2814486
(3-benzyl-2-oxo-2,3-dihydro-1H-benzimidazol-1-yl)acetic acid
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1H-Indole-1-carboxamide, 2,3-dihydro-N-(4-methylphenyl)-
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Orphine
CID 21262767

Frequently Asked Questions

What is the IUPAC name of 2-(3-methyl-2-oxobenzimidazol-1-yl)-N-(2-methylphenyl)acetamide?
The IUPAC name of 2-(3-methyl-2-oxobenzimidazol-1-yl)-N-(2-methylphenyl)acetamide (CID 664058) is 2-(3-methyl-2-oxobenzimidazol-1-yl)-N-(2-methylphenyl)acetamide.
What is the SMILES notation for 2-(3-methyl-2-oxobenzimidazol-1-yl)-N-(2-methylphenyl)acetamide?
The canonical SMILES for 2-(3-methyl-2-oxobenzimidazol-1-yl)-N-(2-methylphenyl)acetamide is Cc1ccccc1NC(=O)Cn1c(=O)n(C)c2ccccc21.
What is the InChIKey of 2-(3-methyl-2-oxobenzimidazol-1-yl)-N-(2-methylphenyl)acetamide?
The InChIKey is NCMFYCSLSXUGGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O2/c1-12-7-3-4-8-13(12)18-16(21)11-20-15-10-6-5-9-14(15)19(2)17(20)22/h3-10H,11H2,1-2H3,(H,18,21).
What are the key properties of 2-(3-methyl-2-oxobenzimidazol-1-yl)-N-(2-methylphenyl)acetamide?
2-(3-methyl-2-oxobenzimidazol-1-yl)-N-(2-methylphenyl)acetamide has a molecular weight of 295.34 g/mol, XLogP of 2.29, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methyl-2-oxobenzimidazol-1-yl)-N-(2-methylphenyl)acetamide is sourced from PubChem (CID 664058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).