ChemSpider 2D Image | N-Methyl-1-[1-(4-morpholinyl)cyclohexyl]-N-({3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)methanamine | C22H29F3N4O2

N-Methyl-1-[1-(4-morpholinyl)cyclohexyl]-N-({3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)methanamine

  • Molecular FormulaC22H29F3N4O2
  • Average mass438.487 Da
  • Monoisotopic mass438.224274 Da
  • ChemSpider ID22138957

More details:

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

1,2,4-Oxadiazole-5-methanamine, N-methyl-N-[[1-(4-morpholinyl)cyclohexyl]methyl]-3-[4-(trifluoromethyl)phenyl]- [ACD/Index Name]
N-Methyl-1-[1-(4-morpholinyl)cyclohexyl]-N-({3-[4-(trifluormethyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)methanamin [German] [ACD/IUPAC Name]
N-Methyl-1-[1-(4-morpholinyl)cyclohexyl]-N-({3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)methanamine [ACD/IUPAC Name]
N-Méthyl-1-[1-(4-morpholinyl)cyclohexyl]-N-({3-[4-(trifluorométhyl)phényl]-1,2,4-oxadiazol-5-yl}méthyl)méthanamine [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 505.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.5±3.0 kJ/mol
Flash Point: 259.4±32.9 °C
Index of Refraction: 1.525
Molar Refractivity: 109.5±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.86
ACD/LogD (pH 5.5): 2.98
ACD/BCF (pH 5.5): 48.97
ACD/KOC (pH 5.5): 219.78
ACD/LogD (pH 7.4): 4.31
ACD/BCF (pH 7.4): 1039.93
ACD/KOC (pH 7.4): 4667.19
Polar Surface Area: 55 Å2
Polarizability: 43.4±0.5 10-24cm3
Surface Tension: 43.1±3.0 dyne/cm
Molar Volume: 357.2±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement