ChemSpider 2D Image | 5-Chloro-N-{(1R,2R,4S)-4-[(4,4-difluoro-1-piperidinyl)carbonyl]-2-hydroxycyclopentyl}-2-pyridinecarboxamide | C17H20ClF2N3O3

5-Chloro-N-{(1R,2R,4S)-4-[(4,4-difluoro-1-piperidinyl)carbonyl]-2-hydroxycyclopentyl}-2-pyridinecarboxamide

  • Molecular FormulaC17H20ClF2N3O3
  • Average mass387.809 Da
  • Monoisotopic mass387.116119 Da
  • ChemSpider ID107753108

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

2-Pyridinecarboxamide, 5-chloro-N-[(1R,2R,4S)-4-[(4,4-difluoro-1-piperidinyl)carbonyl]-2-hydroxycyclopentyl]- [ACD/Index Name]
5-Chlor-N-{(1R,2R,4S)-4-[(4,4-difluor-1-piperidinyl)carbonyl]-2-hydroxycyclopentyl}-2-pyridincarboxamid [German] [ACD/IUPAC Name]
5-Chloro-N-{(1R,2R,4S)-4-[(4,4-difluoro-1-piperidinyl)carbonyl]-2-hydroxycyclopentyl}-2-pyridinecarboxamide [ACD/IUPAC Name]
5-Chloro-N-{(1R,2R,4S)-4-[(4,4-difluoro-1-pipéridinyl)carbonyl]-2-hydroxycyclopentyl}-2-pyridinecarboxamide [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 612.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.6±3.0 kJ/mol
Flash Point: 324.3±31.5 °C
Index of Refraction: 1.582
Molar Refractivity: 90.3±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.16
ACD/LogD (pH 5.5): 0.64
ACD/BCF (pH 5.5): 1.80
ACD/KOC (pH 5.5): 53.00
ACD/LogD (pH 7.4): 0.64
ACD/BCF (pH 7.4): 1.80
ACD/KOC (pH 7.4): 53.00
Polar Surface Area: 83 Å2
Polarizability: 35.8±0.5 10-24cm3
Surface Tension: 58.6±5.0 dyne/cm
Molar Volume: 270.5±5.0 cm3

Click to predict properties on the Chemicalize site


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