N-[(1-Methyl-4-Piperidinyl)Methyl]-3-[3-(Trifluoromethoxy)Phenyl]Imidazo[1,2-B]Pyridazin-6-Amine

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Properties Simple | Detailed

Formula C20H22F3N5O
IUPAC Name n-[(1-methyl-4-piperidyl)methyl]-3-[3-(trifluoromethoxy)phenyl]imidazo[1,2-b]pyridazin-4-ium-8a-ylium-6-amine
Molecular Mass 405.417 g·mol−1
Heat of Formation -430.7 ± 16.7 kJ·mol−1
Dipole Moment 2.91 ± 1.08 D
Volume 467.26 Å 3
Surface Area 378.64 Å 2
HOMO Energy -8.82 ± 0.55 eV
LUMO Energy 2.07 ± eV
Point Group Symmetry C1
Synonyms
  • (1-methyl-4-piperidyl)methyl-[3-[3-(trifluoromethoxy)phenyl]imidazo[2,1-f]pyridazin-6-yl]amine
  • n-[(1-methyl-4-piperidinyl)methyl]-3-[3-(trifluoromethoxy)phenyl]-6-imidazo[2,1-f]pyridazinamine
  • n-[(1-methyl-4-piperidyl)methyl]-3-[3-(trifluoromethoxy)phenyl]imidazo[2,1-f]pyridazin-6-amine
InChIKey MHXGEROHKGDZGO-UHFFFAOYSA-N
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