ChemSpider 2D Image | (3E)-N-Cyclopropyl-N-(1-ethyl-4-piperidinyl)-4-(3-fluorophenyl)-3-butenamide | C20H27FN2O

(3E)-N-Cyclopropyl-N-(1-ethyl-4-piperidinyl)-4-(3-fluorophenyl)-3-butenamide

  • Molecular FormulaC20H27FN2O
  • Average mass330.440 Da
  • Monoisotopic mass330.210754 Da
  • ChemSpider ID35151039

  • Double-bond stereo - Double-bond stereo

More details:

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

(3E)-N-Cyclopropyl-N-(1-ethyl-4-piperidinyl)-4-(3-fluorophenyl)-3-butenamide [ACD/IUPAC Name]
(3E)-N-Cyclopropyl-N-(1-éthyl-4-pipéridinyl)-4-(3-fluorophényl)-3-buténamide [French] [ACD/IUPAC Name]
(3E)-N-Cyclopropyl-N-(1-ethyl-4-piperidinyl)-4-(3-fluorphenyl)-3-butenamid [German] [ACD/IUPAC Name]
3-Butenamide, N-cyclopropyl-N-(1-ethyl-4-piperidinyl)-4-(3-fluorophenyl)-, (3E)- [ACD/Index Name]
(3E)-N-CYCLOPROPYL-N-(1-ETHYLPIPERIDIN-4-YL)-4-(3-FLUOROPHENYL)BUT-3-ENAMIDE

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

Density: 1.1±0.1 g/cm3
Boiling Point: 471.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.4±3.0 kJ/mol
Flash Point: 238.9±28.7 °C
Index of Refraction: 1.570
Molar Refractivity: 95.4±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.25
ACD/LogD (pH 5.5): 0.80
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.21
ACD/LogD (pH 7.4): 2.31
ACD/BCF (pH 7.4): 16.14
ACD/KOC (pH 7.4): 106.21
Polar Surface Area: 24 Å2
Polarizability: 37.8±0.5 10-24cm3
Surface Tension: 45.4±5.0 dyne/cm
Molar Volume: 290.6±5.0 cm3

Click to predict properties on the Chemicalize site


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