Basic information
- Standard SMILES
CC(N)CCN1CC(Oc2ccc(Cl)cc2)C1- InChIKey
MXUCWQSQDZOHNY-UHFFFAOYSA-N- Molecular formula
- C13H19ClN2O
- Average molar mass
- 254.75 g/mol
Names & identifiers
- Preferred name
- 4-[3-(4-Chlorophenoxy)azetidin-1-yl]butan-2-amine
- IUPAC
- 4-[3-(4-chlorophenoxy)azetidin-1-yl]butan-2-amine
Database identifiers
- PubChem CID
- 77617044
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 38.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 225
Related reactions
2 records
Compound notes
Loading…