ChemSpider 2D Image | 1-[1-(2-Fluorobenzyl)-4-piperidinyl]-N-(1H-imidazol-4-ylmethyl)-N-(tetrahydro-2-furanylmethyl)methanamine | C22H31FN4O

1-[1-(2-Fluorobenzyl)-4-piperidinyl]-N-(1H-imidazol-4-ylmethyl)-N-(tetrahydro-2-furanylmethyl)methanamine

  • Molecular FormulaC22H31FN4O
  • Average mass386.506 Da
  • Monoisotopic mass386.248199 Da
  • ChemSpider ID29420832

More details:

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

1-[1-(2-Fluorbenzyl)-4-piperidinyl]-N-(1H-imidazol-4-ylmethyl)-N-(tetrahydro-2-furanylmethyl)methanamin [German] [ACD/IUPAC Name]
1-[1-(2-Fluorobenzyl)-4-piperidinyl]-N-(1H-imidazol-4-ylmethyl)-N-(tetrahydro-2-furanylmethyl)methanamine [ACD/IUPAC Name]
1-[1-(2-Fluorobenzyl)-4-pipéridinyl]-N-(1H-imidazol-4-ylméthyl)-N-(tétrahydro-2-furanylméthyl)méthanamine [French] [ACD/IUPAC Name]
4-Piperidinemethanamine, 1-[(2-fluorophenyl)methyl]-N-(1H-imidazol-4-ylmethyl)-N-[(tetrahydro-2-furanyl)methyl]- [ACD/Index Name]
({1-[(2-FLUOROPHENYL)METHYL]PIPERIDIN-4-YL}METHYL)(1H-IMIDAZOL-4-YLMETHYL)(OXOLAN-2-YLMETHYL)AMINE
({1-[(2-FLUOROPHENYL)METHYL]PIPERIDIN-4-YL}METHYL)[(1H-IMIDAZOL-4-YL)METHYL][(OXOLAN-2-YL)METHYL]AMINE

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

Density: 1.2±0.1 g/cm3
Boiling Point: 543.8±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.2±3.0 kJ/mol
Flash Point: 282.7±25.9 °C
Index of Refraction: 1.573
Molar Refractivity: 108.5±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.01
ACD/LogD (pH 5.5): -1.32
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.57
ACD/BCF (pH 7.4): 4.93
ACD/KOC (pH 7.4): 52.39
Polar Surface Area: 44 Å2
Polarizability: 43.0±0.5 10-24cm3
Surface Tension: 49.3±3.0 dyne/cm
Molar Volume: 329.4±3.0 cm3

Click to predict properties on the Chemicalize site


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