ChemSpider 2D Image | 1-[1-(Tetrahydro-2H-pyran-4-yl)-4-piperidinyl]-4-[5-(trifluoromethyl)-2-pyridinyl]piperazine | C20H29F3N4O

1-[1-(Tetrahydro-2H-pyran-4-yl)-4-piperidinyl]-4-[5-(trifluoromethyl)-2-pyridinyl]piperazine

  • Molecular FormulaC20H29F3N4O
  • Average mass398.466 Da
  • Monoisotopic mass398.229340 Da
  • ChemSpider ID35003532

More details:

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

1-[1-(Tetrahydro-2H-pyran-4-yl)-4-piperidinyl]-4-[5-(trifluormethyl)-2-pyridinyl]piperazin [German] [ACD/IUPAC Name]
1-[1-(Tetrahydro-2H-pyran-4-yl)-4-piperidinyl]-4-[5-(trifluoromethyl)-2-pyridinyl]piperazine [ACD/IUPAC Name]
1-[1-(Tétrahydro-2H-pyran-4-yl)-4-pipéridinyl]-4-[5-(trifluorométhyl)-2-pyridinyl]pipérazine [French] [ACD/IUPAC Name]
Piperazine, 1-[1-(tetrahydro-2H-pyran-4-yl)-4-piperidinyl]-4-[5-(trifluoromethyl)-2-pyridinyl]- [ACD/Index Name]
1-(1-(tetrahydro-2H-pyran-4-yl)piperidin-4-yl)-4-(5-(trifluoromethyl)pyridin-2-yl)piperazine
1-[1-(oxan-4-yl)piperidin-4-yl]-4-[5-(trifluoromethyl)pyridin-2-yl]piperazine
2034479-08-6 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 493.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.1±3.0 kJ/mol
Flash Point: 252.5±28.7 °C
Index of Refraction: 1.537
Molar Refractivity: 100.5±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.98
ACD/LogD (pH 5.5): 0.61
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.53
ACD/LogD (pH 7.4): 2.78
ACD/BCF (pH 7.4): 39.80
ACD/KOC (pH 7.4): 227.00
Polar Surface Area: 32 Å2
Polarizability: 39.8±0.5 10-24cm3
Surface Tension: 44.0±3.0 dyne/cm
Molar Volume: 321.8±3.0 cm3

Click to predict properties on the Chemicalize site


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