ChemSpider 2D Image | N~2~-(1H-Indol-3-ylacetyl)-3-methyl-L-valinamide | C16H21N3O2

N2-(1H-Indol-3-ylacetyl)-3-methyl-L-valinamide

  • Molecular FormulaC16H21N3O2
  • Average mass287.357 Da
  • Monoisotopic mass287.163391 Da
  • ChemSpider ID115285267

  • 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)-2,2-dimethylpropyl]- [ACD/Index Name]
N2-(1H-Indol-3-ylacetyl)-3-methyl-L-valinamid [German] [ACD/IUPAC Name]
N2-(1H-Indol-3-ylacetyl)-3-methyl-L-valinamide [ACD/IUPAC Name]
N2-[2-(1H-Indol-3-yl)acétyl]-3-méthyl-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: 602.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.7±3.0 kJ/mol
Flash Point: 318.5±28.7 °C
Index of Refraction: 1.605
Molar Refractivity: 83.0±0.3 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.36
ACD/LogD (pH 5.5): 1.62
ACD/BCF (pH 5.5): 10.01
ACD/KOC (pH 5.5): 181.01
ACD/LogD (pH 7.4): 1.62
ACD/BCF (pH 7.4): 10.01
ACD/KOC (pH 7.4): 181.01
Polar Surface Area: 88 Å2
Polarizability: 32.9±0.5 10-24cm3
Surface Tension: 51.6±3.0 dyne/cm
Molar Volume: 240.9±3.0 cm3

Click to predict properties on the Chemicalize site


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