ChemSpider 2D Image | N~2~-{[1-(Cyclohexylmethyl)-1H-indol-3-yl]acetyl}-L-valinamide | C22H31N3O2

N2-{[1-(Cyclohexylmethyl)-1H-indol-3-yl]acetyl}-L-valinamide

  • Molecular FormulaC22H31N3O2
  • Average mass369.500 Da
  • Monoisotopic mass369.241638 Da
  • ChemSpider ID128938032

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

1H-Indole-3-acetamide, N-[(1S)-1-(aminocarbonyl)-2-methylpropyl]-1-(cyclohexylmethyl)- [ACD/Index Name]
N2-{[1-(Cyclohexylmethyl)-1H-indol-3-yl]acetyl}-L-valinamid [German] [ACD/IUPAC Name]
N2-{[1-(Cyclohexylmethyl)-1H-indol-3-yl]acetyl}-L-valinamide [ACD/IUPAC Name]
N2-{2-[1-(Cyclohexylméthyl)-1H-indol-3-yl]acétyl}-L-valinamide [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 644.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.1±3.0 kJ/mol
Flash Point: 343.5±28.7 °C
Index of Refraction: 1.613
Molar Refractivity: 106.5±0.5 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.00
ACD/LogD (pH 5.5): 4.05
ACD/BCF (pH 5.5): 710.60
ACD/KOC (pH 5.5): 3826.43
ACD/LogD (pH 7.4): 4.05
ACD/BCF (pH 7.4): 710.60
ACD/KOC (pH 7.4): 3826.43
Polar Surface Area: 77 Å2
Polarizability: 42.2±0.5 10-24cm3
Surface Tension: 45.8±7.0 dyne/cm
Molar Volume: 306.2±7.0 cm3

Click to predict properties on the Chemicalize site


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