ChemSpider 2D Image | (5R)-N-Benzyl-5-({(2S)-2-[(1R)-1,2-dihydroxyethyl]-1-pyrrolidinyl}carbonyl)-1-cyclopentene-1-carboxamide | C20H26N2O4

(5R)-N-Benzyl-5-({(2S)-2-[(1R)-1,2-dihydroxyethyl]-1-pyrrolidinyl}carbonyl)-1-cyclopentene-1-carboxamide

  • Molecular FormulaC20H26N2O4
  • Average mass358.431 Da
  • Monoisotopic mass358.189270 Da
  • ChemSpider ID35034895

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(5R)-N-Benzyl-5-({(2S)-2-[(1R)-1,2-dihydroxyethyl]-1-pyrrolidinyl}carbonyl)-1-cyclopenten-1-carboxamid [German] [ACD/IUPAC Name]
(5R)-N-Benzyl-5-({(2S)-2-[(1R)-1,2-dihydroxyethyl]-1-pyrrolidinyl}carbonyl)-1-cyclopentene-1-carboxamide [ACD/IUPAC Name]
(5R)-N-Benzyl-5-({(2S)-2-[(1R)-1,2-dihydroxyéthyl]-1-pyrrolidinyl}carbonyl)-1-cyclopentène-1-carboxamide [French] [ACD/IUPAC Name]
(5r)-N-Benzyl-5-({(2s)-2-[(1r)-1,2-Dihydroxyethyl]pyrrolidin-1-Yl}carbonyl)cyclopent-1-Ene-1-Carboxamide
1-Cyclopentene-1-carboxamide, 5-[[(2S)-2-[(1R)-1,2-dihydroxyethyl]-1-pyrrolidinyl]carbonyl]-N-(phenylmethyl)-, (5R)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 687.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 105.8±3.0 kJ/mol
Flash Point: 369.5±31.5 °C
Index of Refraction: 1.612
Molar Refractivity: 96.8±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: -0.13
ACD/LogD (pH 5.5): 0.46
ACD/BCF (pH 5.5): 1.32
ACD/KOC (pH 5.5): 42.44
ACD/LogD (pH 7.4): 0.46
ACD/BCF (pH 7.4): 1.32
ACD/KOC (pH 7.4): 42.44
Polar Surface Area: 90 Å2
Polarizability: 38.4±0.5 10-24cm3
Surface Tension: 62.3±3.0 dyne/cm
Molar Volume: 278.5±3.0 cm3

Click to predict properties on the Chemicalize site


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