4-methoxy-N-(5-methyl-3-isoxazolyl)benzamide

HCID 670263

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Basic information

CAS: 109300-31-4
Standard SMILES: COc1ccc(C(=O)Nc2cc(C)on2)cc1
InChIKey: NCSMCVZNYCCOGI-UHFFFAOYSA-N
Molecular formula: C12H12N2O3
Average molar mass: 232.23 g/mol
Monoisotopic mass: 232.08479225

Overview

4-methoxy-N-(5-methyl-3-isoxazolyl)benzamide is a member of benzamides.

Names & identifiers

Preferred name: 4-methoxy-N-(5-methyl-3-isoxazolyl)benzamide
IUPAC: 4-methoxy-N-(5-methyl-1,2-oxazol-3-yl)benzamide

Names & synonyms

109300-31-44-methoxy-N-(5-methyl-1,2-oxazol-3-yl)benzamide4-methoxy-N-(5-methyl-3-isoxazolyl)benzamide4-methoxy-N-(5-methylisoxazol-3-yl)benzamideSMR000107219MLS000111294Benzamide, 4-methoxy-N-(5-methyl-3-isoxazolyl)-Cambridge id 6615860Oprea1_525724Oprea1_544423cid_670263CHEMBL1518161

Show more names

BDBM39566DTXSID50349991CHEBI:120543HMS2404A19STK033938AKOS000646911ST043983AB00112279-01

Database identifiers

CAS: 109300-31-4
PubChem CID: 670263
DTXSID: DTXSID50349991
ChEMBL: CHEMBL1518161
ChEBI: CHEBI:120543
Nikkaji: J1.142.111C

Properties

Computed structural properties

XLogP: 1.9
Topological polar surface area: 64.4 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 4
Rotatable bonds: 3
Heavy atoms: 17
Formal charge: 0
Complexity: 264

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