ChemSpider 2D Image | 1-{[3-(2-Fluorobenzyl)-1,2,4-oxadiazol-5-yl]methyl}-3-(1-pyrrolidinylmethyl)piperidine | C20H27FN4O

1-{[3-(2-Fluorobenzyl)-1,2,4-oxadiazol-5-yl]methyl}-3-(1-pyrrolidinylmethyl)piperidine

  • Molecular FormulaC20H27FN4O
  • Average mass358.453 Da
  • Monoisotopic mass358.216888 Da
  • ChemSpider ID23064720

More details:

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

1-{[3-(2-Fluorbenzyl)-1,2,4-oxadiazol-5-yl]methyl}-3-(1-pyrrolidinylmethyl)piperidin [German] [ACD/IUPAC Name]
1-{[3-(2-Fluorobenzyl)-1,2,4-oxadiazol-5-yl]methyl}-3-(1-pyrrolidinylmethyl)piperidine [ACD/IUPAC Name]
1-{[3-(2-Fluorobenzyl)-1,2,4-oxadiazol-5-yl]méthyl}-3-(1-pyrrolidinylméthyl)pipéridine [French] [ACD/IUPAC Name]
Piperidine, 1-[[3-[(2-fluorophenyl)methyl]-1,2,4-oxadiazol-5-yl]methyl]-3-(1-pyrrolidinylmethyl)- [ACD/Index 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: 488.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.4±3.0 kJ/mol
Flash Point: 249.1±31.5 °C
Index of Refraction: 1.564
Molar Refractivity: 98.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.11
ACD/LogD (pH 5.5): -0.25
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.70
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.18
Polar Surface Area: 45 Å2
Polarizability: 39.0±0.5 10-24cm3
Surface Tension: 49.7±3.0 dyne/cm
Molar Volume: 302.1±3.0 cm3

Click to predict properties on the Chemicalize site


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