3-Cyclopropyl-5-Phenyl-N-(3-Pyridinylmethyl)Pyrazolo[1,5-A]Pyrimidin-7-Amine

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Properties Simple | Detailed

Formula C21H19N5
IUPAC Name 3-cyclopropyl-5-phenyl-n-(3-pyridylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine
Molecular Mass 341.409 g·mol−1
Heat of Formation 652.3 ± 16.7 kJ·mol−1
Dipole Moment 4.29 ± 1.08 D
Volume 413.58 Å 3
Surface Area 375.77 Å 2
HOMO Energy -8.41 ± 0.55 eV
LUMO Energy 1.17 ± eV
Point Group Symmetry C1
Synonyms
  • (3-cyclopropyl-5-phenyl-pyrazolo[5,1-b]pyrimidin-7-yl)-(3-pyridylmethyl)amine
  • 3-cyclopropyl-5-phenyl-n-(3-pyridylmethyl)-7-pyrazolo[5,1-b]pyrimidinamine
  • 3-cyclopropyl-5-phenyl-n-(3-pyridylmethyl)pyrazolo[5,1-b]pyrimidin-7-amine
  • 3-cyclopropyl-5-phenyl-n-(pyridin-3-ylmethyl)pyrazolo[5,1-b]pyrimidin-7-amine
InChIKey CCDIUVLNHCGSMH-UHFFFAOYSA-N
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Elements H C N