Basic information
- Standard SMILES
CC(C)C(Br)C(=O)N1CCC(c2ccc(Cl)cc2)CC1- InChIKey
MAATXCBFHPJVFO-UHFFFAOYSA-N- Molecular formula
- C16H21BrClNO
- Average molar mass
- 358.7 g/mol
Names & identifiers
- Preferred name
- 2-Bromo-1-(4-(4-chlorophenyl)piperidin-1-yl)-3-methylbutan-1-one
- IUPAC
- 2-bromo-1-[4-(4-chlorophenyl)piperidin-1-yl]-3-methylbutan-1-one
Names & synonyms
SCHEMBL2159157MAATXCBFHPJVFO-UHFFFAOYSA-N2-bromo-1-(4-(4-chlorophenyl)piperidin-1-yl)-3-methylbutan-1-one
Database identifiers
- PubChem CID
- 57889673
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 320
Related reactions
6 records
Compound notes
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