ChemSpider 2D Image | Benzyl 4-{[cyclopropyl(glycyl)amino]methyl}-1-piperidinecarboxylate | C19H27N3O3

Benzyl 4-{[cyclopropyl(glycyl)amino]methyl}-1-piperidinecarboxylate

  • Molecular FormulaC19H27N3O3
  • Average mass345.436 Da
  • Monoisotopic mass345.205231 Da
  • ChemSpider ID28297948

More details:

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

1353946-39-0 [RN]
1-Piperidinecarboxylic acid, 4-[[(2-aminoacetyl)cyclopropylamino]methyl]-, phenylmethyl ester [ACD/Index Name]
4-{[Cyclopropyl(glycyl)amino]méthyl}-1-pipéridinecarboxylate de benzyle [French] [ACD/IUPAC Name]
BENZYL 4-[(2-AMINO-N-CYCLOPROPYLACETAMIDO)METHYL]PIPERIDINE-1-CARBOXYLATE
Benzyl 4-{[cyclopropyl(glycyl)amino]methyl}-1-piperidinecarboxylate [ACD/IUPAC Name]
Benzyl-4-{[cyclopropyl(glycyl)amino]methyl}-1-piperidincarboxylat [German] [ACD/IUPAC Name]
4-{[(2-Amino-acetyl)-cyclopropyl-amino]-methyl }-piperidine-1-carboxylic acid benzyl ester
4-{[(2-Aminoacetyl)cyclopropylamino]methyl}piperidine-1-carboxylic acid benzyl ester
4-{[(2-Amino-acetyl)-cyclopropyl-amino]-methyl}piperidine-1-carboxylic acid benzyl ester
4-{[(2-Amino-acetyl)-cyclopropyl-amino]-methyl}-piperidine-1-carboxylic acid benzyl ester
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 522.7±43.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 79.6±3.0 kJ/mol
Flash Point: 269.9±28.2 °C
Index of Refraction: 1.595
Molar Refractivity: 96.2±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.10
ACD/LogD (pH 5.5): -1.12
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.58
ACD/BCF (pH 7.4): 1.04
ACD/KOC (pH 7.4): 21.10
Polar Surface Area: 76 Å2
Polarizability: 38.1±0.5 10-24cm3
Surface Tension: 56.0±5.0 dyne/cm
Molar Volume: 283.1±5.0 cm3

Click to predict properties on the Chemicalize site


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