Piperidine, N-acetyl-4-benzyl-
Basic information
- CAS
101997-42-6- Standard SMILES
CC(=O)N1CCC(Cc2ccccc2)CC1- InChIKey
BKQOKWBHIBQLIH-UHFFFAOYSA-N- Molecular formula
- C14H19NO
- Average molar mass
- 217.31 g/mol
- Monoisotopic mass
- 217.14666423
Names & identifiers
- Preferred name
- Piperidine, N-acetyl-4-benzyl-
- IUPAC
- 1-(4-benzylpiperidin-1-yl)ethanone
Names & synonyms
N-Acetyl-4-benzylpiperidinePiperidine, N-acetyl-4-benzyl-101997-42-6BRN 1640720DTXSID80144496RefChem:373312DTXCID20669871-(4-benzylpiperidin-1-yl)ethan-1-one1-acetyl-4-benzylpiperidineCHEMBL80049NSC172876SCHEMBL3026559
Show more names
SCHEMBL8815358BKQOKWBHIBQLIH-UHFFFAOYSA-NBDBM50472792MFCD00495705AKOS003235551EBC-606978NSC-172876ST043136
Database identifiers
- CAS
101997-42-6- PubChem CID
- 299608
- DTXSID
DTXSID80144496- ChEMBL
CHEMBL80049- Nikkaji
- J62.710K
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 225
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Related reactions
2 records
Compound notes
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