3-Chloro-6-phenyl-4-(1-piperidyl)pyran-2-one
Basic information
- CAS
70486-05-4- Standard SMILES
O=c1oc(-c2ccccc2)cc(N2CCCCC2)c1Cl- InChIKey
DTPIBYOZZPKARH-UHFFFAOYSA-N- Molecular formula
- C16H16ClNO2
- Average molar mass
- 289.75 g/mol
- Monoisotopic mass
- 289.0869564
Names & identifiers
- Preferred name
- 3-Chloro-6-phenyl-4-(1-piperidyl)pyran-2-one
- IUPAC
- 3-chloro-6-phenyl-4-piperidin-1-ylpyran-2-one
- English name
- 3-chloro-6-phenyl-4-(1-piperidyl)pyran-2-one
- Molecular formula
- C16H16ClNO2
- Molecular weight
- 0
Names & synonyms
70486-05-43-chloro-6-phenyl-4-(1-piperidyl)pyran-2-oneNSC315562DTXSID20317440NSC-3155623-Chloro-6-phenyl-4-(piperidin-1-yl)-2H-pyran-2-one
Database identifiers
- CAS
70486-05-4- PubChem CID
- 330052
- DTXSID
DTXSID20317440
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 443
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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