Basic information
- CAS
87498-60-0- Standard SMILES
CC(Cc1ccccc1)NN1CCCCCC1- InChIKey
HDRDMYCGSLKJNT-UHFFFAOYSA-N- Molecular formula
- C15H24N2
- Average molar mass
- 232.36 g/mol
- Monoisotopic mass
- 232.19394877
Names & identifiers
- Preferred name
- 1H-Azepin-1-amine, hexahydro-N-(1-methyl-2-phenylethyl)-
- IUPAC
- N-(1-phenylpropan-2-yl)azepan-1-amine
Names & synonyms
87498-60-01H-AZEPIN-1-AMINE, HEXAHYDRO-N-(1-METHYL-2-PHENYLETHYL)-RefChem:1057778Hexahydro-N-(1-methyl-2-phenylethyl)-1H-azepin-1-amineN-(1-phenylpropan-2-yl)azepan-1-amineDTXSID701007597
Database identifiers
- CAS
87498-60-0- PubChem CID
- 55720
- DTXSID
DTXSID701007597
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 15.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 191
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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