Basic information
- Standard SMILES
CC(=O)N1CCCc2ccccc2C1- InChIKey
IVYYINUFLIWZOE-UHFFFAOYSA-N- Molecular formula
- C12H15NO
- Average molar mass
- 189.25 g/mol
Names & identifiers
- Preferred name
- 1-(1,3,4,5-Tetrahydro-2H-2-benzazepin-2-yl)ethanone
- IUPAC
- 1-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)ethanone
Names & synonyms
SCHEMBL7227468IVYYINUFLIWZOE-UHFFFAOYSA-NAKOS0129738491-(1,3,4,5-Tetrahydro-2H-2-benzazepin-2-yl)ethanone
Database identifiers
- PubChem CID
- 10465110
- Nikkaji
- J613.110G
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 214
Related reactions
2 records
Compound notes
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