3-(2,5-Dimethylphenyl)pyridin-2(1H)-one

HCID 53217543

Notes Reactions

Substructure search Find similar structures

Basic information

CAS: 1261940-54-8
Standard SMILES: Cc1ccc(C)c(-c2ccc[nH]c2=O)c1
InChIKey: BSCYNAMRQXFUQM-UHFFFAOYSA-N
Molecular formula: C13H13NO
Average molar mass: 199.25 g/mol
Monoisotopic mass: 199.09971404

Names & identifiers

Preferred name: 3-(2,5-Dimethylphenyl)pyridin-2(1H)-one
IUPAC: 3-(2,5-dimethylphenyl)-1H-pyridin-2-one

Names & synonyms

1261940-54-83-(2,5-dimethylphenyl)-1H-pyridin-2-one3-(2,5-Dimethylphenyl)pyridin-2(1H)-oneMFCD18311972DTXSID30682575AKOS0063169483-(2,5-DIMETHYLPHENYL)-2-HYDROXYPYRIDINE3-(2,5-Dimethylphenyl)-2-hydroxypyridine, 95%

Database identifiers

CAS: 1261940-54-8
PubChem CID: 53217543
DTXSID: DTXSID30682575

Properties

Computed structural properties

XLogP: 2.6
Topological polar surface area: 29.1 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 1
Rotatable bonds: 1
Heavy atoms: 15
Formal charge: 0
Complexity: 316

Related reactions

0 records

New reaction record

No reaction records under the current filter.

Compound notes

Loading…