ChemSpider 2D Image | (4-Amino-2-pyridinyl){4-[4-(1-pyrrolidinylmethyl)-1H-1,2,3-triazol-1-yl]-1-piperidinyl}methanone | C18H25N7O

(4-Amino-2-pyridinyl){4-[4-(1-pyrrolidinylmethyl)-1H-1,2,3-triazol-1-yl]-1-piperidinyl}methanone

  • Molecular FormulaC18H25N7O
  • Average mass355.437 Da
  • Monoisotopic mass355.212067 Da
  • ChemSpider ID22503198

More details:

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

(4-Amino-2-pyridinyl){4-[4-(1-pyrrolidinylmethyl)-1H-1,2,3-triazol-1-yl]-1-piperidinyl}methanon [German] [ACD/IUPAC Name]
(4-Amino-2-pyridinyl){4-[4-(1-pyrrolidinylmethyl)-1H-1,2,3-triazol-1-yl]-1-piperidinyl}methanone [ACD/IUPAC Name]
(4-Amino-2-pyridinyl){4-[4-(1-pyrrolidinylméthyl)-1H-1,2,3-triazol-1-yl]-1-pipéridinyl}méthanone [French] [ACD/IUPAC Name]
Methanone, (4-amino-2-pyridinyl)[4-[4-(1-pyrrolidinylmethyl)-1H-1,2,3-triazol-1-yl]-1-piperidinyl]- [ACD/Index Name]
2-({4-[4-(pyrrolidin-1-ylmethyl)-1H-1,2,3-triazol-1-yl]piperidin-1-yl}carbonyl)pyridin-4-amine

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

Density: 1.4±0.1 g/cm3
Boiling Point: 637.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.2±3.0 kJ/mol
Flash Point: 339.4±34.3 °C
Index of Refraction: 1.728
Molar Refractivity: 99.1±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.75
ACD/LogD (pH 5.5): -3.25
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.04
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.36
Polar Surface Area: 93 Å2
Polarizability: 39.3±0.5 10-24cm3
Surface Tension: 64.3±7.0 dyne/cm
Molar Volume: 248.8±7.0 cm3

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