ChemSpider 2D Image | Phenylalanyl-N-[2-(4-pyridinylamino)ethyl]prolinamide | C21H27N5O2

Phenylalanyl-N-[2-(4-pyridinylamino)ethyl]prolinamide

  • Molecular FormulaC21H27N5O2
  • Average mass381.471 Da
  • Monoisotopic mass381.216461 Da
  • ChemSpider ID21395435

More details:

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

[phenylalaninyl-prolinyl]-[2-(pyridin-4-ylamino)-ethyl]-amine
Phenylalanyl-N-[2-(4-pyridinylamino)ethyl]prolinamid [German] [ACD/IUPAC Name]
Phenylalanyl-N-[2-(4-pyridinylamino)ethyl]prolinamide [ACD/IUPAC Name]
Phénylalanyl-N-[2-(4-pyridinylamino)éthyl]prolinamide [French] [ACD/IUPAC Name]
Prolinamide, phenylalanyl-N-[2-(4-pyridinylamino)ethyl]- [ACD/Index Name]
(2S)-1-[(2R)-2-amino-3-phenylpropanoyl]-N-[2-(pyridin-4-ylamino)ethyl]pyrrolidine-2-carboxamide
(2S)-1-[(2R)-2-amino-3-phenylpropanoyl]-N-{2-[(pyridin-4-yl)amino]ethyl}pyrrolidine-2-carboxamide
CHEMBL65273

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

Density: 1.2±0.1 g/cm3
Boiling Point: 709.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 103.8±3.0 kJ/mol
Flash Point: 382.9±32.9 °C
Index of Refraction: 1.628
Molar Refractivity: 108.5±0.3 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 1.37
ACD/LogD (pH 5.5): -2.53
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.28
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 10.69
Polar Surface Area: 100 Å2
Polarizability: 43.0±0.5 10-24cm3
Surface Tension: 63.3±3.0 dyne/cm
Molar Volume: 305.9±3.0 cm3

Click to predict properties on the Chemicalize site


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