ChemSpider 2D Image | 4-[(3R)-3-(2-Butynoylamino)-1-piperidinyl]-5-fluoro-2,3-dimethyl-1H-indole-7-carboxamide | C20H23FN4O2

4-[(3R)-3-(2-Butynoylamino)-1-piperidinyl]-5-fluoro-2,3-dimethyl-1H-indole-7-carboxamide

  • Molecular FormulaC20H23FN4O2
  • Average mass370.421 Da
  • Monoisotopic mass370.180511 Da
  • ChemSpider ID82963840

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

1H-Indole-7-carboxamide, 5-fluoro-2,3-dimethyl-4-[(3R)-3-[(1-oxo-2-butyn-1-yl)amino]-1-piperidinyl]- [ACD/Index Name]
4-[(3R)-3-(2-Butynoylamino)-1-piperidinyl]-5-fluor-2,3-dimethyl-1H-indol-7-carboxamid [German] [ACD/IUPAC Name]
4-[(3R)-3-(2-Butynoylamino)-1-piperidinyl]-5-fluoro-2,3-dimethyl-1H-indole-7-carboxamide [ACD/IUPAC Name]
4-[(3R)-3-(2-Butynoylamino)-1-pipéridinyl]-5-fluoro-2,3-diméthyl-1H-indole-7-carboxamide [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.644
Molar Refractivity: 101.2±0.4 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.09
ACD/LogD (pH 5.5): 2.73
ACD/BCF (pH 5.5): 70.44
ACD/KOC (pH 5.5): 731.65
ACD/LogD (pH 7.4): 2.73
ACD/BCF (pH 7.4): 70.44
ACD/KOC (pH 7.4): 731.63
Polar Surface Area: 91 Å2
Polarizability: 40.1±0.5 10-24cm3
Surface Tension: 64.8±5.0 dyne/cm
Molar Volume: 279.5±5.0 cm3

Click to predict properties on the Chemicalize site


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