2,5-Dimethyl-3-(6-{Methyl[(~11~C)Methyl]Amino}-3-Pyridinyl)-N,N-Dipropylpyrazolo[1,5-A]Pyrimidin-7-Amine

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Formula C21H30N6
IUPAC Name 3-[6-(dimethylamino)-3-pyridyl]-2,5-dimethyl-n,n-dipropyl-pyrazolo[1,5-a]pyrimidin-8-ium-7-amine
Molecular Mass 365.504 g·mol−1
Heat of Formation 290.3 ± 16.7 kJ·mol−1
Dipole Moment 5.14 ± 1.08 D
Volume 473.63 Å 3
Surface Area 416.21 Å 2
HOMO Energy -8.02 ± 0.55 eV
LUMO Energy 0.04 ± eV
Point Group Symmetry C1
Synonyms
  • 3-[6-(di(methyl)amino)-3-pyridyl]-2,5-dimethyl-n,n-dipropyl-7-pyrazolo[5,1-b]pyrimidinamine
  • 3-[6-(di(methyl)amino)-3-pyridyl]-2,5-dimethyl-n,n-dipropyl-pyrazolo[5,1-b]pyrimidin-7-amine
  • 3-[6-(di(methyl)amino)pyridin-3-yl]-2,5-dimethyl-n,n-dipropyl-pyrazolo[5,1-b]pyrimidin-7-amine
  • 3-[6-(di(methyl)amino)pyridin-3-yl]-2,5-dimethyl-n,n-dipropylpyrazolo[5,1-b]pyrimidin-7-amine
  • [3-[6-(di(methyl)amino)-3-pyridyl]-2,5-dimethyl-pyrazolo[5,1-b]pyrimidin-7-yl]-dipropyl-amine
InChIKey QJEURMFEYXHROW-SFIIULIVSA-N
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