rel-4-Bromo-N-[(1S,2S)-2-(dimethylamino)cyclohexyl]benzamide hydrochloride (1:1)
Basic information
- Standard SMILES
CN(C)[C@H]1CCCC[C@@H]1NC(=O)c1ccc(Br)cc1.Cl- InChIKey
ATYJDUHKGPBKFS-IODNYQNNSA-N- Molecular formula
- C15H22BrClN2O
- Average molar mass
- 361.7 g/mol
- Monoisotopic mass
- 360.0604
Names & identifiers
- Preferred name
- rel-4-Bromo-N-[(1S,2S)-2-(dimethylamino)cyclohexyl]benzamide hydrochloride (1:1)
- IUPAC
- 4-bromo-N-[(1S,2S)-2-(dimethylamino)cyclohexyl]benzamide;hydrochloride
Names & synonyms
DTXSID701348303rel-4-Bromo-N-[(1S,2S)-2-(dimethylamino)cyclohexyl]benzamide hydrochloride (1:1)
Database identifiers
- PubChem CID
- 165362467
- DTXSID
DTXSID701348303
Properties
Computed structural properties
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 301
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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