1-Benzyl-3-piperidone
Properties
- Molecular formula
- C12H15NO
- Molar mass
- 189.26 g/mol
- Exact mass
- 189.1154 Da
- logP
- 1.85Crippen estimate
- Polar surface area
- 20.3 Ų
- H-bond donors / acceptors
- 0 / 2
- Rotatable bonds
- 2
Hazards
No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library
Identifiers
CAS number
40114-49-6SMILES
C1CC(=O)CN(C1)CC2=CC=CC=C2InChIKey
BBQQULRBTOMLTC-UHFFFAOYSA-NInChI
InChI=1S/C12H15NO/c14-12-7-4-8-13(10-12)9-11-5-2-1-3-6-11/h1-3,5-6H,4,7-10H2Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
1 names
- 3-Piperidinone, 1-(phenylmethyl)-
Work with 1-Benzyl-3-piperidone
Stereoisomers, salts and isotopologues
The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.
Similar compounds
1-(Phenylmethyl)-3-pyrrolidinone775-16-680 % similar
1-Benzyl-hexahydro-4H-azepin-4-one1208-75-978 % similar
1-Benzylpiperidine2905-56-855 % similar
1-Benzyl-2-pyrrolidinone5291-77-053 % similar
N-Phenethyl-4-piperidinone39742-60-451 % similar
Benzyl 3-oxopiperidine-1-carboxylate61995-20-851 % similar
1,4,7,10-Tetrabenzyl-1,4,7,10-tetraazacyclododecane18084-64-550 % similar
N-(Carboxymethyl)-N-(phenylmethyl)glycine3987-53-950 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds