Basic information
- Standard SMILES
O=C1C=CCCN1Cc1ccc(F)c(Cl)c1- InChIKey
LTTNKXJWPNWJNI-UHFFFAOYSA-N- Molecular formula
- C12H11ClFNO
- Average molar mass
- 239.67 g/mol
Names & identifiers
- Preferred name
- 1-(3-Chloro-4-fluorobenzyl)-5,6-dihydropyridin-2(1H)-one
- IUPAC
- 1-[(3-chloro-4-fluorophenyl)methyl]-2,3-dihydropyridin-6-one
Names & synonyms
1-(3-Chloro-4-fluorobenzyl)-5,6-dihydropyridin-2(1H)-oneSCHEMBL1337878LTTNKXJWPNWJNI-UHFFFAOYSA-N1-(3-chloro-4-fluorobenzyl)-5,6-dihydro-1h-pyridin-2-one1-(3-Chloro-4-fluorobenzyl)-5,6-dihydropyridin-2 (1H)-one
Database identifiers
- PubChem CID
- 59455604
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 295
Related reactions
16 records
Compound notes
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