N-(2-methoxy-5-methylphenyl)-2-oxo-2-(pyrrolidin-1-yl)acetamide

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Basic information

CAS: 489435-08-7
Standard SMILES: COc1ccc(C)cc1NC(=O)C(=O)N1CCCC1
InChIKey: BYBSIIMIZTXOTQ-UHFFFAOYSA-N
Molecular formula: C14H18N2O3
Average molar mass: 262.3 g/mol
Monoisotopic mass: 262.13174244

Names & identifiers

Preferred name: N-(2-methoxy-5-methylphenyl)-2-oxo-2-(pyrrolidin-1-yl)acetamide
IUPAC: N-(2-methoxy-5-methylphenyl)-2-oxo-2-pyrrolidin-1-ylacetamide

Names & synonyms

N-(2-methoxy-5-methylphenyl)-2-oxo-2-(pyrrolidin-1-yl)acetamideN-(2-methoxy-5-methylphenyl)-2-oxo-2-pyrrolidin-1-ylacetamide489435-08-7MLS000332645CHEMBL1883541DTXSID801329669HMS2807G18STK150982AKOS005406562SMR000435958N-(2-Methoxy-5-methyl-phenyl)-2-oxo-2-pyrrolidin-1-yl-acetamide

Database identifiers

CAS: 489435-08-7
PubChem CID: 4264255
DTXSID: DTXSID801329669
ChEMBL: CHEMBL1883541

Properties

Computed structural properties

XLogP: 1.8
Topological polar surface area: 58.6 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 2
Heavy atoms: 19
Formal charge: 0
Complexity: 340

Experimental & physicochemical properties

Solubility39.1 [ug/mL] (The mean of the results at pH 7.4)

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Compound notes

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