ChemSpider 2D Image | (2S)-2-Cyclopentyl-2-phenyl-N-{[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-2-piperidinyl]methyl}acetamide | C20H30N2O4

(2S)-2-Cyclopentyl-2-phenyl-N-{[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-2-piperidinyl]methyl}acetamide

  • Molecular FormulaC20H30N2O4
  • Average mass362.463 Da
  • Monoisotopic mass362.220551 Da
  • ChemSpider ID25060150

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

(2S)-2-Cyclopentyl-2-phenyl-N-{[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-2-piperidinyl]methyl}acetamid [German] [ACD/IUPAC Name]
(2S)-2-Cyclopentyl-2-phenyl-N-{[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-2-piperidinyl]methyl}acetamide [ACD/IUPAC Name]
(2S)-2-Cyclopentyl-2-phényl-N-{[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-méthyl-2-pipéridinyl]méthyl}acétamide [French] [ACD/IUPAC Name]
(2s)-2-Cyclopentyl-2-Phenyl-N-{[(2r,3r,4r,5r,6s)-3,4,5-Trihydroxy-6-Methylpiperidin-2-Yl]methyl}ethanamide
Benzeneacetamide, α-cyclopentyl-N-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-2-piperidinyl]methyl]-, (αS)- [ACD/Index Name]
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 601.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 94.1±3.0 kJ/mol
Flash Point: 317.4±31.5 °C
Index of Refraction: 1.583
Molar Refractivity: 99.0±0.3 cm3
#H bond acceptors: 6
#H bond donors: 5
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 1.32
ACD/LogD (pH 5.5): -0.74
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.11
ACD/LogD (pH 7.4): 0.91
ACD/BCF (pH 7.4): 2.32
ACD/KOC (pH 7.4): 48.89
Polar Surface Area: 102 Å2
Polarizability: 39.3±0.5 10-24cm3
Surface Tension: 50.0±3.0 dyne/cm
Molar Volume: 296.2±3.0 cm3

Click to predict properties on the Chemicalize site


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