ChemSpider 2D Image | (3S)-1-(3-Amino-1,6-dimethyl-1H-pyrazolo[4,3-c]pyridin-4-yl)-3-pyrrolidinol | C12H17N5O

(3S)-1-(3-Amino-1,6-dimethyl-1H-pyrazolo[4,3-c]pyridin-4-yl)-3-pyrrolidinol

  • Molecular FormulaC12H17N5O
  • Average mass247.296 Da
  • Monoisotopic mass247.143311 Da
  • ChemSpider ID26633790

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S)-1-(3-Amino-1,6-dimethyl-1H-pyrazolo[4,3-c]pyridin-4-yl)-3-pyrrolidinol [German] [ACD/IUPAC Name]
(3S)-1-(3-Amino-1,6-dimethyl-1H-pyrazolo[4,3-c]pyridin-4-yl)-3-pyrrolidinol [ACD/IUPAC Name]
(3S)-1-(3-Amino-1,6-diméthyl-1H-pyrazolo[4,3-c]pyridin-4-yl)-3-pyrrolidinol [French] [ACD/IUPAC Name]
3-Pyrrolidinol, 1-(3-amino-1,6-dimethyl-1H-pyrazolo[4,3-c]pyridin-4-yl)-, (3S)- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 530.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.8±3.0 kJ/mol
Flash Point: 274.8±30.1 °C
Index of Refraction: 1.749
Molar Refractivity: 66.6±0.5 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.69
ACD/LogD (pH 5.5): -1.94
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.92
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 80 Å2
Polarizability: 26.4±0.5 10-24cm3
Surface Tension: 61.8±7.0 dyne/cm
Molar Volume: 163.6±7.0 cm3

Click to predict properties on the Chemicalize site


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