[(2S)-1-cyclohexylpropan-2-yl](methyl)amine

• ChemBase ID: 128059
• Molecular Formular: C10H21N
• Molecular Mass: 155.28044
• Monoisotopic Mass: 155.16739968
• SMILES: N([C@H](CC1CCCCC1)C)C
• Canonical SMILES: CN[C@H](CC1CCCCC1)C
• InChI: InChI=1S/C10H21N/c1-9(11-2)8-10-6-4-3-5-7-10/h9-11H,3-8H2,1-2H3/t9-/m0/s1
• InChIKey: JCRIVQIOJSSCQD-VIFPVBQESA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: [(2S)-1-cyclohexylpropan-2-yl](methyl)amine
• IUPAC Traditional name: levopropylhexedrine
• Synonyms: Levopropylhexedrine

Database IDs

• CAS Number: 6192-97-8
• PubChem SID: 162222375
• PubChem CID: 71197
• Chemspider ID: 64333
• Unique Ingredient Identifier: 4R3L4TYV09
• Wikipedia Title: Levopropylhexedrine

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): -0.53163725
• LogD (pH = 7.4): -0.22243364
• Log P: 2.7045949
• Molar Refractivity: 49.5352 cm^3
• Polarizability: 19.986317 Å^3
• Polar Surface Area: 12.03 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: true

PROPERTIES

Pharmacology Properties

• Admin Routes: Oral
• Legal Status: Rx-only