ChemSpider 2D Image | Ethyl N-{[4-(cyclopropylcarbamoyl)-4-fluoro-1-piperidinyl]carbonyl}-beta-alaninate | C15H24FN3O4

Ethyl N-{[4-(cyclopropylcarbamoyl)-4-fluoro-1-piperidinyl]carbonyl}-β-alaninate

  • Molecular FormulaC15H24FN3O4
  • Average mass329.367 Da
  • Monoisotopic mass329.175079 Da
  • ChemSpider ID65240734

More details:

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

Ethyl N-{[4-(cyclopropylcarbamoyl)-4-fluoro-1-piperidinyl]carbonyl}-β-alaninate [ACD/IUPAC Name]
Ethyl-N-{[4-(cyclopropylcarbamoyl)-4-fluor-1-piperidinyl]carbonyl}-β-alaninat [German] [ACD/IUPAC Name]
N-{[4-(Cyclopropylcarbamoyl)-4-fluoro-1-pipéridinyl]carbonyl}-β-alaninate d'éthyle [French] [ACD/IUPAC Name]
β-Alanine, N-[[4-[(cyclopropylamino)carbonyl]-4-fluoro-1-piperidinyl]carbonyl]-, ethyl ester [ACD/Index Name]
ethyl 3-[({4-[(cyclopropylamino)carbonyl]-4-fluoropiperidino}carbonyl)amino]propanoate

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

Density: 1.3±0.1 g/cm3
Boiling Point: 589.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.0±3.0 kJ/mol
Flash Point: 310.3±30.1 °C
Index of Refraction: 1.526
Molar Refractivity: 80.8±0.4 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 0.30
ACD/LogD (pH 5.5): 0.61
ACD/BCF (pH 5.5): 1.72
ACD/KOC (pH 5.5): 51.21
ACD/LogD (pH 7.4): 0.61
ACD/BCF (pH 7.4): 1.72
ACD/KOC (pH 7.4): 51.21
Polar Surface Area: 88 Å2
Polarizability: 32.0±0.5 10-24cm3
Surface Tension: 48.2±5.0 dyne/cm
Molar Volume: 263.3±5.0 cm3

Click to predict properties on the Chemicalize site


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