ChemSpider 2D Image | 2-Methyl-2-propanyl [3-({1-[4-(dimethylamino)-1-piperidinyl]-1-oxo-2-hexanyl}amino)-3-oxopropyl](3-pyridinylmethyl)carbamate | C27H45N5O4

2-Methyl-2-propanyl [3-({1-[4-(dimethylamino)-1-piperidinyl]-1-oxo-2-hexanyl}amino)-3-oxopropyl](3-pyridinylmethyl)carbamate

  • Molecular FormulaC27H45N5O4
  • Average mass503.677 Da
  • Monoisotopic mass503.347168 Da
  • ChemSpider ID121768826

More details:

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

[3-({1-[4-(Diméthylamino)-1-pipéridinyl]-1-oxo-2-hexanyl}amino)-3-oxopropyl](3-pyridinylméthyl)carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl [3-({1-[4-(dimethylamino)-1-piperidinyl]-1-oxo-2-hexanyl}amino)-3-oxopropyl](3-pyridinylmethyl)carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-[3-({1-[4-(dimethylamino)-1-piperidinyl]-1-oxo-2-hexanyl}amino)-3-oxopropyl](3-pyridinylmethyl)carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-[3-[[1-[[4-(dimethylamino)-1-piperidinyl]carbonyl]pentyl]amino]-3-oxopropyl]-N-(3-pyridinylmethyl)-, 1,1-dimethylethyl ester [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 688.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 101.0±3.0 kJ/mol
Flash Point: 370.3±31.5 °C
Index of Refraction: 1.546
Molar Refractivity: 141.7±0.4 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 1
ACD/LogP: 3.35
ACD/LogD (pH 5.5): -0.17
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.36
ACD/BCF (pH 7.4): 2.91
ACD/KOC (pH 7.4): 29.77
Polar Surface Area: 95 Å2
Polarizability: 56.2±0.5 10-24cm3
Surface Tension: 49.5±5.0 dyne/cm
Molar Volume: 447.4±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement