[(1R)-1,2-diphenylethyl]dimethylamine

• ChemBase ID: 130345
• Molecular Formular: C16H19N
• Molecular Mass: 225.32876
• Monoisotopic Mass: 225.15174961
• SMILES: CN([C@@H](c1ccccc1)Cc1ccccc1)C
• Canonical SMILES: CN([C@@H](c1ccccc1)Cc1ccccc1)C
• InChI: InChI=1S/C16H19N/c1-17(2)16(15-11-7-4-8-12-15)13-14-9-5-3-6-10-14/h3-12,16H,13H2,1-2H3/t16-/m1/s1
• InChIKey: YEJZJVJJPVZXGX-MRXNPFEDSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: [(1R)-1,2-diphenylethyl]dimethylamine
• IUPAC Traditional name: lefetamine
• Synonyms: Lefetamine

Database IDs

• CAS Number: 7262-75-1
• PubChem SID: 162224624
• PubChem CID: 443970
• Chemspider ID: 392017
• Unique Ingredient Identifier: 4J9726V5Y9
• Wikipedia Title: Lefetamine

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 0.6011602
• LogD (pH = 7.4): 1.8824276
• Log P: 3.987544
• Molar Refractivity: 73.6385 cm^3
• Polarizability: 28.855099 Å^3
• Polar Surface Area: 3.24 Å^2
• Rotatable Bonds: 4
• Lipinski's Rule of Five: true

PROPERTIES

Pharmacology Properties

• Admin Routes: Oral
• Legal Status: Schedule IV (USA)