ChemSpider 2D Image | METHYL-PHE-PRO-AMINO-CYCLOHEXYLGLYCINE | C22H34N4O2

METHYL-PHE-PRO-AMINO-CYCLOHEXYLGLYCINE

  • Molecular FormulaC22H34N4O2
  • Average mass386.531 Da
  • Monoisotopic mass386.268188 Da
  • ChemSpider ID26330356

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

L-Prolinamide, N-methyl-D-phenylalanyl-N-[(cis-4-aminocyclohexyl)methyl]- [ACD/Index Name]
METHYL-PHE-PRO-AMINO-CYCLOHEXYLGLYCINE
N-Methyl-D-phenylalanyl-N-[(cis-4-aminocyclohexyl)methyl]-L-prolinamid [German] [ACD/IUPAC Name]
N-Methyl-D-phenylalanyl-N-[(cis-4-aminocyclohexyl)methyl]-L-prolinamide [ACD/IUPAC Name]
N-Méthyl-D-phénylalanyl-N-[(cis-4-aminocyclohexyl)méthyl]-L-prolinamide [French] [ACD/IUPAC Name]
(2S)-1-[(2R)-2-(methylamino)-3-phenylpropanoyl]-N-{[(1s,4s)-4-aminocyclohexyl]methyl}pyrrolidine-2-carboxamide

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

Density: 1.1±0.1 g/cm3
Boiling Point: 633.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 93.6±3.0 kJ/mol
Flash Point: 336.9±31.5 °C
Index of Refraction: 1.556
Molar Refractivity: 110.6±0.3 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.24
ACD/LogD (pH 5.5): -2.48
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.75
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 87 Å2
Polarizability: 43.8±0.5 10-24cm3
Surface Tension: 46.9±3.0 dyne/cm
Molar Volume: 344.0±3.0 cm3

Click to predict properties on the Chemicalize site


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