N-[3-(furan-2-yl)-4-phenylbutyl]-N-(1-phenylethyl)acetamide

• ChemBase ID: 192521
• Molecular Formular: C24H27NO2
• Molecular Mass: 361.47668
• Monoisotopic Mass: 361.20417911
• SMILES: N(C(=O)C)(C(c1ccccc1)C)CCC(c1occc1)Cc1ccccc1
• Canonical SMILES: CC(=O)N(C(c1ccccc1)C)CCC(c1ccco1)Cc1ccccc1
• InChI: InChI=1S/C24H27NO2/c1-19(22-12-7-4-8-13-22)25(20(2)26)16-15-23(24-14-9-17-27-24)18-21-10-5-3-6-11-21/h3-14,17,19,23H,15-16,18H2,1-2H3
• InChIKey: QGOAJGBPGUDRQY-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: N-[3-(furan-2-yl)-4-phenylbutyl]-N-(1-phenylethyl)acetamide
• IUPAC Traditional name: N-[3-(furan-2-yl)-4-phenylbutyl]-N-(1-phenylethyl)acetamide

Database IDs

• PubChem SID: 164248431
• PubChem CID: 3702263

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 4.863499
• LogD (pH = 7.4): 4.8634996
• Log P: 4.8634996
• Molar Refractivity: 108.9718 cm^3
• Polarizability: 42.26793 Å^3
• Polar Surface Area: 33.45 Å^2
• Rotatable Bonds: 8
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Description: 2 Diastereomers
• Classification: Derivatives & analogs of Natural Compounds