ChemSpider 2D Image | 1-(2-Fluorobenzyl)-N-[4-methoxy-3-(1H-pyrazol-1-ylmethyl)benzyl]-3-piperidinamine | C24H29FN4O

1-(2-Fluorobenzyl)-N-[4-methoxy-3-(1H-pyrazol-1-ylmethyl)benzyl]-3-piperidinamine

  • Molecular FormulaC24H29FN4O
  • Average mass408.512 Da
  • Monoisotopic mass408.232544 Da
  • ChemSpider ID22220289

More details:

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

1-(2-Fluorbenzyl)-N-[4-methoxy-3-(1H-pyrazol-1-ylmethyl)benzyl]-3-piperidinamin [German] [ACD/IUPAC Name]
1-(2-Fluorobenzyl)-N-[4-methoxy-3-(1H-pyrazol-1-ylmethyl)benzyl]-3-piperidinamine [ACD/IUPAC Name]
1-(2-Fluorobenzyl)-N-[4-méthoxy-3-(1H-pyrazol-1-ylméthyl)benzyl]-3-pipéridinamine [French] [ACD/IUPAC Name]
3-Piperidinamine, 1-[(2-fluorophenyl)methyl]-N-[[4-methoxy-3-(1H-pyrazol-1-ylmethyl)phenyl]methyl]- [ACD/Index Name]
1-[(2-FLUOROPHENYL)METHYL]-N-({4-METHOXY-3-[(1H-PYRAZOL-1-YL)METHYL]PHENYL}METHYL)PIPERIDIN-3-AMINE
1-[(2-FLUOROPHENYL)METHYL]-N-{[4-METHOXY-3-(PYRAZOL-1-YLMETHYL)PHENYL]METHYL}PIPERIDIN-3-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: 547.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.7±3.0 kJ/mol
Flash Point: 284.9±30.1 °C
Index of Refraction: 1.602
Molar Refractivity: 118.1±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.23
ACD/LogD (pH 5.5): 0.29
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.88
ACD/BCF (pH 7.4): 5.15
ACD/KOC (pH 7.4): 29.90
Polar Surface Area: 42 Å2
Polarizability: 46.8±0.5 10-24cm3
Surface Tension: 43.0±7.0 dyne/cm
Molar Volume: 344.2±7.0 cm3

Click to predict properties on the Chemicalize site


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