N-[1-(4-{[4-(2-Pyrimidinyl)-1-Piperazinyl]Methyl}Phenyl)Cyclopropyl]Acetamide

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Properties Simple | Detailed

Formula C20H25N5O
IUPAC Name n-[1-[4-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]phenyl]cyclopropyl]acetamide
Molecular Mass 351.445 g·mol−1
Heat of Formation 163.3 ± 16.7 kJ·mol−1
Dipole Moment 5.00 ± 1.08 D
Volume 435.78 Å 3
Surface Area 379.61 Å 2
HOMO Energy -8.77 ± 0.55 eV
LUMO Energy -0.10 ± eV
Point Group Symmetry C1
Synonyms
  • n-[1-[4-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]phenyl]cyclopropyl]acetamide
  • n-[1-[4-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]phenyl]cyclopropyl]ethanamide
  • n-[1-[4-[[4-(2-pyrimidinyl)-1-piperazinyl]methyl]phenyl]cyclopropyl]acetamide
InChIKey QUVHZANTGRHKML-UHFFFAOYSA-N
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