ChemSpider 2D Image | 1-{2-[2-(3-{[Methyl(8-quinolinylmethyl)amino]methyl}phenoxy)ethyl]-1-piperidinyl}-2-(1-piperidinyl)ethanone | C32H42N4O2

1-{2-[2-(3-{[Methyl(8-quinolinylmethyl)amino]methyl}phenoxy)ethyl]-1-piperidinyl}-2-(1-piperidinyl)ethanone

  • Molecular FormulaC32H42N4O2
  • Average mass514.701 Da
  • Monoisotopic mass514.330750 Da
  • ChemSpider ID22166749

More details:

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

1-{2-[2-(3-{[(8-Chinolinylmethyl)(methyl)amino]methyl}phenoxy)ethyl]-1-piperidinyl}-2-(1-piperidinyl)ethanon [German] [ACD/IUPAC Name]
1-{2-[2-(3-{[Méthyl(8-quinoléinylméthyl)amino]méthyl}phénoxy)éthyl]-1-pipéridinyl}-2-(1-pipéridinyl)éthanone [French] [ACD/IUPAC Name]
1-{2-[2-(3-{[Methyl(8-quinolinylmethyl)amino]methyl}phenoxy)ethyl]-1-piperidinyl}-2-(1-piperidinyl)ethanone [ACD/IUPAC Name]
Ethanone, 1-[2-[2-[3-[[methyl(8-quinolinylmethyl)amino]methyl]phenoxy]ethyl]-1-piperidinyl]-2-(1-piperidinyl)- [ACD/Index Name]
N-methyl-1-(3-{2-[1-(1-piperidinylacetyl)-2-piperidinyl]ethoxy}phenyl)-N-(8-quinolinylmethyl)methanamine

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

Density: 1.1±0.1 g/cm3
Boiling Point: 665.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.8±3.0 kJ/mol
Flash Point: 356.0±30.1 °C
Index of Refraction: 1.597
Molar Refractivity: 154.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 5.53
ACD/LogD (pH 5.5): 1.36
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.73
ACD/LogD (pH 7.4): 4.28
ACD/BCF (pH 7.4): 693.10
ACD/KOC (pH 7.4): 2285.43
Polar Surface Area: 49 Å2
Polarizability: 61.2±0.5 10-24cm3
Surface Tension: 49.4±3.0 dyne/cm
Molar Volume: 452.9±3.0 cm3

Click to predict properties on the Chemicalize site


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