Basic information
- Standard SMILES
Cc1ccccc1CCc1ccccc1OCCC1CCCN1C- InChIKey
KOKYPRPUZQRRLU-UHFFFAOYSA-N- Molecular formula
- C22H29NO
- Average molar mass
- 323.5 g/mol
- Monoisotopic mass
- 323.22491455
Names & identifiers
- Preferred name
- 1-Methyl-2-(2-{2-[2-(2-methylphenyl)ethyl]phenoxy}ethyl)pyrrolidine
- IUPAC
- 1-methyl-2-[2-[2-[2-(2-methylphenyl)ethyl]phenoxy]ethyl]pyrrolidine
Names & synonyms
SCHEMBL8707528KOKYPRPUZQRRLU-UHFFFAOYSA-N1-Methyl-2-(2-{2-[2-(2-methylphenyl)ethyl]phenoxy}ethyl)pyrrolidine
Database identifiers
- PubChem CID
- 19423965
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 12.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 358
Related reactions
3 records
Compound notes
Loading…