ChemSpider 2D Image | 1-[6-ethyl-8-fluoro-4-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)quinolin-2-yl]-N-(oxan-4-yl)piperidin-4-amine | C25H32FN5O2

1-[6-ethyl-8-fluoro-4-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)quinolin-2-yl]-N-(oxan-4-yl)piperidin-4-amine

  • Molecular FormulaC25H32FN5O2
  • Average mass453.552 Da
  • Monoisotopic mass453.253998 Da
  • ChemSpider ID78316413

More details:

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

1-[6-Ethyl-8-fluor-4-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)-2-chinolinyl]-N-(tetrahydro-2H-pyran-4-yl)-4-piperidinamin [German] [ACD/IUPAC Name]
1-[6-Éthyl-8-fluoro-4-méthyl-3-(3-méthyl-1,2,4-oxadiazol-5-yl)-2-quinoléinyl]-N-(tétrahydro-2H-pyran-4-yl)-4-pipéridinamine [French] [ACD/IUPAC Name]
1-[6-Ethyl-8-fluoro-4-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)-2-quinolinyl]-N-(tetrahydro-2H-pyran-4-yl)-4-piperidinamine [ACD/IUPAC Name]
1-[6-ethyl-8-fluoro-4-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)quinolin-2-yl]-N-(oxan-4-yl)piperidin-4-amine
2244614-14-8 [RN]
4-Piperidinamine, 1-[6-ethyl-8-fluoro-4-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)-2-quinolinyl]-N-(tetrahydro-2H-pyran-4-yl)- [ACD/Index Name]
BTRX-335140
Navacaprant
NMRA-140
XK5Ilz28KI

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

Density: 1.3±0.1 g/cm3
Boiling Point: 649.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.8±3.0 kJ/mol
Flash Point: 346.8±34.3 °C
Index of Refraction: 1.614
Molar Refractivity: 125.0±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.96
ACD/LogD (pH 5.5): 0.94
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.63
ACD/LogD (pH 7.4): 2.38
ACD/BCF (pH 7.4): 16.89
ACD/KOC (pH 7.4): 100.74
Polar Surface Area: 76 Å2
Polarizability: 49.5±0.5 10-24cm3
Surface Tension: 59.9±5.0 dyne/cm
Molar Volume: 358.5±5.0 cm3

Click to predict properties on the Chemicalize site


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