ChemSpider 2D Image | N-{[4-(Methoxymethyl)-4-piperidinyl]methyl}-N~2~-[(2-methyl-2-propanyl)carbamoyl]-L-valinamide | C18H36N4O3

N-{[4-(Methoxymethyl)-4-piperidinyl]methyl}-N2-[(2-methyl-2-propanyl)carbamoyl]-L-valinamide

  • Molecular FormulaC18H36N4O3
  • Average mass356.503 Da
  • Monoisotopic mass356.278748 Da
  • ChemSpider ID63936173

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

Butanamide, 2-[[[(1,1-dimethylethyl)amino]carbonyl]amino]-N-[[4-(methoxymethyl)-4-piperidinyl]methyl]-3-methyl-, (2S)- [ACD/Index Name]
N-{[4-(Methoxymethyl)-4-piperidinyl]methyl}-N2-[(2-methyl-2-propanyl)carbamoyl]-L-valinamid [German] [ACD/IUPAC Name]
N-{[4-(Methoxymethyl)-4-piperidinyl]methyl}-N2-[(2-methyl-2-propanyl)carbamoyl]-L-valinamide [ACD/IUPAC Name]
N-{[4-(Méthoxyméthyl)-4-pipéridinyl]méthyl}-N2-[(2-méthyl-2-propanyl)carbamoyl]-L-valinamide [French] [ACD/IUPAC Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 555.9±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.7±3.0 kJ/mol
Flash Point: 290.0±23.2 °C
Index of Refraction: 1.474
Molar Refractivity: 99.1±0.3 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 0.60
ACD/LogD (pH 5.5): -2.01
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.52
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 91 Å2
Polarizability: 39.3±0.5 10-24cm3
Surface Tension: 36.6±3.0 dyne/cm
Molar Volume: 352.5±3.0 cm3

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