Basic information
- Standard SMILES
CC(C)(C(N)c1ccccc1)N1CCCCCC1- InChIKey
PUKACCHKFMGGBP-UHFFFAOYSA-N- Molecular formula
- C16H26N2
- Average molar mass
- 246.39 g/mol
Names & identifiers
- Preferred name
- (+/-)[2-(Hexahydro-1H-azepin-1-yl)-2-methyl-1-phenylpropyl]amine
- IUPAC
- 2-(azepan-1-yl)-2-methyl-1-phenylpropan-1-amine
Names & synonyms
SCHEMBL3245018PUKACCHKFMGGBP-UHFFFAOYSA-NAKOS017601445(+/-)[2-(Hexahydro-1H-azepin-1-yl)-2-methyl-1-phenylpropyl]amine
Database identifiers
- PubChem CID
- 59347889
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 29.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 235
Related reactions
1 records
Compound notes
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