ChemSpider 2D Image | N-[3-Methyl-1-({3-[2-(4-morpholinyl)ethoxy]benzyl}amino)-1-oxo-2-butanyl]-1-adamantanecarboxamide | C29H43N3O4

N-[3-Methyl-1-({3-[2-(4-morpholinyl)ethoxy]benzyl}amino)-1-oxo-2-butanyl]-1-adamantanecarboxamide

  • Molecular FormulaC29H43N3O4
  • Average mass497.669 Da
  • Monoisotopic mass497.325348 Da
  • ChemSpider ID30087944

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

N-[3-Methyl-1-({3-[2-(4-morpholinyl)ethoxy]benzyl}amino)-1-oxo-2-butanyl]-1-adamantancarboxamid [German] [ACD/IUPAC Name]
N-[3-Methyl-1-({3-[2-(4-morpholinyl)ethoxy]benzyl}amino)-1-oxo-2-butanyl]-1-adamantanecarboxamide [ACD/IUPAC Name]
N-[3-Méthyl-1-({3-[2-(4-morpholinyl)éthoxy]benzyl}amino)-1-oxo-2-butanyl]-1-adamantanecarboxamide [French] [ACD/IUPAC Name]
Tricyclo[3.3.1.13,7]decane-1-carboxamide, N-[2-methyl-1-[[[[3-[2-(4-morpholinyl)ethoxy]phenyl]methyl]amino]carbonyl]propyl]- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 732.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 106.9±3.0 kJ/mol
Flash Point: 396.7±32.9 °C
Index of Refraction: 1.561
Molar Refractivity: 139.1±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 3.46
ACD/LogD (pH 5.5): 2.36
ACD/BCF (pH 5.5): 21.10
ACD/KOC (pH 5.5): 161.38
ACD/LogD (pH 7.4): 3.30
ACD/BCF (pH 7.4): 185.90
ACD/KOC (pH 7.4): 1422.05
Polar Surface Area: 80 Å2
Polarizability: 55.1±0.5 10-24cm3
Surface Tension: 47.2±3.0 dyne/cm
Molar Volume: 429.3±3.0 cm3

Click to predict properties on the Chemicalize site


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