ChemSpider 2D Image | 2-(4-Butylcyclohexyl)-5-{[2-(3-methyl-1-piperidinyl)-2-oxoethyl]amino}-1,3-oxazole-4-carbonitrile | C22H34N4O2

2-(4-Butylcyclohexyl)-5-{[2-(3-methyl-1-piperidinyl)-2-oxoethyl]amino}-1,3-oxazole-4-carbonitrile

  • Molecular FormulaC22H34N4O2
  • Average mass386.531 Da
  • Monoisotopic mass386.268188 Da
  • ChemSpider ID25958228

More details:

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

2-(4-Butylcyclohexyl)-5-{[2-(3-methyl-1-piperidinyl)-2-oxoethyl]amino}-1,3-oxazol-4-carbonitril [German] [ACD/IUPAC Name]
2-(4-Butylcyclohexyl)-5-{[2-(3-methyl-1-piperidinyl)-2-oxoethyl]amino}-1,3-oxazole-4-carbonitrile [ACD/IUPAC Name]
2-(4-Butylcyclohexyl)-5-{[2-(3-méthyl-1-pipéridinyl)-2-oxoéthyl]amino}-1,3-oxazole-4-carbonitrile [French] [ACD/IUPAC Name]
4-Oxazolecarbonitrile, 2-(4-butylcyclohexyl)-5-[[2-(3-methyl-1-piperidinyl)-2-oxoethyl]amino]- [ACD/Index Name]
2-(4-butylcyclohexyl)-5-[[2-(3-methylpiperidin-1-yl)-2-oxoethyl]amino]-1,3-oxazole-4-carbonitrile
2-(4-butylcyclohexyl)-5-{[2-(3-methylpiperidin-1-yl)-2-oxoethyl]amino}-1,3-oxazole-4-carbonitrile

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

Density: 1.1±0.1 g/cm3
Boiling Point: 592.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.4±3.0 kJ/mol
Flash Point: 312.1±28.7 °C
Index of Refraction: 1.544
Molar Refractivity: 108.4±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.97
ACD/LogD (pH 5.5): 4.17
ACD/BCF (pH 5.5): 862.96
ACD/KOC (pH 5.5): 4397.26
ACD/LogD (pH 7.4): 4.17
ACD/BCF (pH 7.4): 862.96
ACD/KOC (pH 7.4): 4397.26
Polar Surface Area: 82 Å2
Polarizability: 43.0±0.5 10-24cm3
Surface Tension: 50.6±5.0 dyne/cm
Molar Volume: 343.5±5.0 cm3

Click to predict properties on the Chemicalize site


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