5-Hydroxy-1,5-dimethyl-2-phenyl-4-piperidinone
Basic information
- CAS
52899-10-2- Standard SMILES
CN1CC(C)(O)C(=O)CC1c1ccccc1- InChIKey
MDUJXZYSSKDEAE-UHFFFAOYSA-N- Molecular formula
- C13H17NO2
- Average molar mass
- 219.28 g/mol
- Monoisotopic mass
- 219.12592879
Names & identifiers
- Preferred name
- 5-Hydroxy-1,5-dimethyl-2-phenyl-4-piperidinone
- IUPAC
- 5-hydroxy-1,5-dimethyl-2-phenylpiperidin-4-one
Names & synonyms
5-Hydroxy-1,5-dimethyl-2-phenyl-4-piperidinone52899-10-2RefChem:3033453a-Hydroxy-1,3-dimethyl-6-phenyl-4-piperidone5-hydroxy-1,5-dimethyl-2-phenylpiperidin-4-oneOprea1_233269MDUJXZYSSKDEAE-UHFFFAOYSA-NDTXSID4012463283-hydroxy-1,3-dimethyl-6-phenyl-4-piperidone5-Hydroxy-1,5-dimethyl-2-phenyl-4-piperidinone #
Database identifiers
- CAS
52899-10-2- PubChem CID
- 583371
- DTXSID
DTXSID401246328
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 273
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Compound notes
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