ChemSpider 2D Image | N-Benzyl-2-{1-[(1-cyclohexyl-1H-pyrazol-4-yl)methyl]-4-(phenoxymethyl)-4-piperidinyl}-N-methylacetamide | C32H42N4O2

N-Benzyl-2-{1-[(1-cyclohexyl-1H-pyrazol-4-yl)methyl]-4-(phenoxymethyl)-4-piperidinyl}-N-methylacetamide

  • Molecular FormulaC32H42N4O2
  • Average mass514.701 Da
  • Monoisotopic mass514.330750 Da
  • ChemSpider ID68396827

More details:

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

4-Piperidineacetamide, 1-[(1-cyclohexyl-1H-pyrazol-4-yl)methyl]-N-methyl-4-(phenoxymethyl)-N-(phenylmethyl)- [ACD/Index Name]
N-Benzyl-2-{1-[(1-cyclohexyl-1H-pyrazol-4-yl)methyl]-4-(phenoxymethyl)-4-piperidinyl}-N-methylacetamid [German] [ACD/IUPAC Name]
N-Benzyl-2-{1-[(1-cyclohexyl-1H-pyrazol-4-yl)methyl]-4-(phenoxymethyl)-4-piperidinyl}-N-methylacetamide [ACD/IUPAC Name]
N-Benzyl-2-{1-[(1-cyclohexyl-1H-pyrazol-4-yl)méthyl]-4-(phénoxyméthyl)-4-pipéridinyl}-N-méthylacétamide [French] [ACD/IUPAC Name]
N-BENZYL-2-{1-[(1-CYCLOHEXYL-1H-PYRAZOL-4-YL)METHYL]-4-(PHENOXYMETHYL)PIPERIDIN-4-YL}-N-METHYLACETAMIDE
N-BENZYL-2-{1-[(1-CYCLOHEXYLPYRAZOL-4-YL)METHYL]-4-(PHENOXYMETHYL)PIPERIDIN-4-YL}-N-METHYLACETAMIDE

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

Density: 1.1±0.1 g/cm3
Boiling Point: 668.6±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 98.3±3.0 kJ/mol
Flash Point: 358.2±27.3 °C
Index of Refraction: 1.604
Molar Refractivity: 154.8±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 5.13
ACD/LogD (pH 5.5): 2.65
ACD/BCF (pH 5.5): 18.43
ACD/KOC (pH 5.5): 67.89
ACD/LogD (pH 7.4): 4.33
ACD/BCF (pH 7.4): 880.66
ACD/KOC (pH 7.4): 3243.72
Polar Surface Area: 51 Å2
Polarizability: 61.4±0.5 10-24cm3
Surface Tension: 45.8±7.0 dyne/cm
Molar Volume: 449.8±7.0 cm3

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