Basic information
- CAS
166809-67-2- Standard SMILES
CC(=O)C1(c2ccccc2)CCN(CCCN)CC1- InChIKey
NTQVHBVWXDUWGU-UHFFFAOYSA-N- Molecular formula
- C16H24N2O
- Average molar mass
- 260.37 g/mol
- Monoisotopic mass
- 260.18886339
Names & identifiers
- Preferred name
- 4-Acetyl-1-(3-aminopropyl)-4-phenylpiperidine
- IUPAC
- 1-[1-(3-aminopropyl)-4-phenylpiperidin-4-yl]ethanone
Names & synonyms
166809-67-24-ACETYL-1-(3-AMINOPROPYL)-4-PHENYLPIPERIDINESCHEMBL6643987DTXSID60442184NTQVHBVWXDUWGU-UHFFFAOYSA-N1-[1-(3-Aminopropyl)-4-phenylpiperidin-4-yl]ethan-1-one
Database identifiers
- CAS
166809-67-2- PubChem CID
- 10587447
- DTXSID
DTXSID60442184
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 46.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 289
Related reactions
6 records
Compound notes
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