ChemSpider 2D Image | {1-[2-Amino-6-(isopropylamino)-4-pyrimidinyl]-3-(2-methoxyethyl)-3-piperidinyl}methanol | C16H29N5O2

{1-[2-Amino-6-(isopropylamino)-4-pyrimidinyl]-3-(2-methoxyethyl)-3-piperidinyl}methanol

  • Molecular FormulaC16H29N5O2
  • Average mass323.434 Da
  • Monoisotopic mass323.232117 Da
  • ChemSpider ID29465762

More details:

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

{1-[2-Amino-6-(isopropylamino)-4-pyrimidinyl]-3-(2-methoxyethyl)-3-piperidinyl}methanol [German] [ACD/IUPAC Name]
{1-[2-Amino-6-(isopropylamino)-4-pyrimidinyl]-3-(2-methoxyethyl)-3-piperidinyl}methanol [ACD/IUPAC Name]
{1-[2-Amino-6-(isopropylamino)-4-pyrimidinyl]-3-(2-méthoxyéthyl)-3-pipéridinyl}méthanol [French] [ACD/IUPAC Name]
3-Piperidinemethanol, 1-[2-amino-6-[(1-methylethyl)amino]-4-pyrimidinyl]-3-(2-methoxyethyl)- [ACD/Index Name]
(1-{2-AMINO-6-[(PROPAN-2-YL)AMINO]PYRIMIDIN-4-YL}-3-(2-METHOXYETHYL)PIPERIDIN-3-YL)METHANOL
[1-[2-amino-6-(isopropylamino)-4-pyrimidinyl]-3-(2-methoxyethyl)-3-piperidinyl]methanol
{1-[2-AMINO-6-(ISOPROPYLAMINO)PYRIMIDIN-4-YL]-3-(2-METHOXYETHYL)PIPERIDIN-3-YL}METHANOL

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

Density: 1.2±0.1 g/cm3
Boiling Point: 557.9±58.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 88.4±3.0 kJ/mol
Flash Point: 291.2±32.3 °C
Index of Refraction: 1.570
Molar Refractivity: 92.2±0.3 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.56
ACD/LogD (pH 5.5): -0.54
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.05
ACD/LogD (pH 7.4): 0.84
ACD/BCF (pH 7.4): 1.52
ACD/KOC (pH 7.4): 25.28
Polar Surface Area: 97 Å2
Polarizability: 36.5±0.5 10-24cm3
Surface Tension: 53.3±3.0 dyne/cm
Molar Volume: 280.7±3.0 cm3

Click to predict properties on the Chemicalize site


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