1-(2,4-dimethoxy-5-propoxyphenyl)propan-2-amine

• ChemBase ID: 128462
• Molecular Formular: C14H23NO3
• Molecular Mass: 253.33732
• Monoisotopic Mass: 253.1677936
• SMILES: COc1cc(OC)c(cc1OCCC)CC(C)N
• Canonical SMILES: CCCOc1cc(CC(N)C)c(cc1OC)OC
• InChI: InChI=1S/C14H23NO3/c1-5-6-18-14-8-11(7-10(2)15)12(16-3)9-13(14)17-4/h8-10H,5-7,15H2,1-4H3
• InChIKey: FTJOFRCENIVFLC-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 1-(2,4-dimethoxy-5-propoxyphenyl)propan-2-amine
• IUPAC Traditional name: mpm (psychedelic)
• Synonyms: MPM (psychedelic)

Database IDs

• PubChem SID: 162222769
• PubChem CID: 57417446
• Chemspider ID: 21106339
• Wikipedia Title: MPM_(psychedelic)

CALCULATED PROPERTIES

• H Acceptors: 4
• H Donor: 1
• LogD (pH = 5.5): -0.805876
• LogD (pH = 7.4): -0.20974644
• Log P: 2.210567
• Molar Refractivity: 72.3674 cm^3
• Polarizability: 28.536104 Å^3
• Polar Surface Area: 53.71 Å^2
• Rotatable Bonds: 7
• Lipinski's Rule of Five: true