Basic information
- Standard SMILES
Cc1ccc(CN2CCC(=O)CC2)cc1- InChIKey
HCANSJOGHLDHGO-UHFFFAOYSA-N- Molecular formula
- C13H17NO
- Average molar mass
- 203.28 g/mol
Names & identifiers
- Preferred name
- 1-(4-Methylbenzyl)piperidin-4-one
- IUPAC
- 1-[(4-methylphenyl)methyl]piperidin-4-one
Names & synonyms
1-(4-methylbenzyl)piperidin-4-one241495-46-51-[(4-methylphenyl)methyl]piperidin-4-oneSCHEMBL4703106SCHEMBL29088788HCANSJOGHLDHGO-UHFFFAOYSA-Nl-(4-methylbenzyl)-4-piperidinone1-(4-methylbenzyl)-4-piperidinoneAKOS000172767DA-30097
Database identifiers
- PubChem CID
- 11959541
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 209
Related reactions
10 records
Compound notes
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