ChemSpider 2D Image | N-(Cyclohexylmethyl)-2-{6-methyl-1-[4-(2-methyl-2-propanyl)benzyl]-5-(4-morpholinylcarbonyl)-2-oxo-1,2,3,4-tetrahydro-3-pyridinyl}acetamide | C31H45N3O4

N-(Cyclohexylmethyl)-2-{6-methyl-1-[4-(2-methyl-2-propanyl)benzyl]-5-(4-morpholinylcarbonyl)-2-oxo-1,2,3,4-tetrahydro-3-pyridinyl}acetamide

  • Molecular FormulaC31H45N3O4
  • Average mass523.707 Da
  • Monoisotopic mass523.341003 Da
  • ChemSpider ID28656108

More details:

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

3-Pyridineacetamide, N-(cyclohexylmethyl)-1-[[4-(1,1-dimethylethyl)phenyl]methyl]-1,2,3,4-tetrahydro-6-methyl-5-(4-morpholinylcarbonyl)-2-oxo- [ACD/Index Name]
N-(Cyclohexylmethyl)-2-{6-methyl-1-[4-(2-methyl-2-propanyl)benzyl]-5-(4-morpholinylcarbonyl)-2-oxo-1,2,3,4-tetrahydro-3-pyridinyl}acetamid [German] [ACD/IUPAC Name]
N-(Cyclohexylmethyl)-2-{6-methyl-1-[4-(2-methyl-2-propanyl)benzyl]-5-(4-morpholinylcarbonyl)-2-oxo-1,2,3,4-tetrahydro-3-pyridinyl}acetamide [ACD/IUPAC Name]
N-(Cyclohexylméthyl)-2-{6-méthyl-1-[4-(2-méthyl-2-propanyl)benzyl]-5-(4-morpholinylcarbonyl)-2-oxo-1,2,3,4-tétrahydro-3-pyridinyl}acétamide [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 756.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 110.2±3.0 kJ/mol
Flash Point: 411.0±32.9 °C
Index of Refraction: 1.547
Molar Refractivity: 148.1±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 4.96
ACD/LogD (pH 5.5): 4.79
ACD/BCF (pH 5.5): 2576.72
ACD/KOC (pH 5.5): 9621.38
ACD/LogD (pH 7.4): 4.79
ACD/BCF (pH 7.4): 2576.72
ACD/KOC (pH 7.4): 9621.39
Polar Surface Area: 79 Å2
Polarizability: 58.7±0.5 10-24cm3
Surface Tension: 44.4±3.0 dyne/cm
Molar Volume: 466.6±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement