N-(2-methylpropyl)-N-[(4Z)-2,2,5,9-tetramethyldeca-4,8-dien-1-yl]acetamide

• ChemBase ID: 185464
• Molecular Formular: C20H37NO
• Molecular Mass: 307.51388
• Monoisotopic Mass: 307.28751481
• SMILES: N(C(=O)C)(CC(C/C=C(\CCC=C(C)C)/C)(C)C)CC(C)C
• Canonical SMILES: CC(CN(C(=O)C)CC(C/C=C(\CCC=C(C)C)/C)(C)C)C
• InChI: InChI=1S/C20H37NO/c1-16(2)10-9-11-18(5)12-13-20(7,8)15-21(19(6)22)14-17(3)4/h10,12,17H,9,11,13-15H2,1-8H3/b18-12-
• InChIKey: UYKRZWHRGVKQJA-PDGQHHTCSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: N-(2-methylpropyl)-N-[(4Z)-2,2,5,9-tetramethyldeca-4,8-dien-1-yl]acetamide
• IUPAC Traditional name: N-(2-methylpropyl)-N-[(4Z)-2,2,5,9-tetramethyldeca-4,8-dien-1-yl]acetamide

Database IDs

• PubChem SID: 164241374
• PubChem CID: 1795123

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 5.15852
• LogD (pH = 7.4): 5.1585307
• Log P: 5.1585307
• Molar Refractivity: 99.15 cm^3
• Polarizability: 38.341507 Å^3
• Polar Surface Area: 20.31 Å^2
• Rotatable Bonds: 9
• Lipinski's Rule of Five: false

PROPERTIES

Product Information

• Classification: Rare Derivatives of Natural Compounds