N-{(3R)-1-[(6-Fluoro-2-Naphthyl)Methyl]-3-Pyrrolidinyl}-2-{1-[(6-Methyl-3-Pyridazinyl)Carbonyl]-4-Piperidinylidene}Acetamide

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Properties Simple | Detailed

Formula C28H30FN5O2
IUPAC Name n-[(1s,3r)-1-[(6-fluoro-2-naphthyl)methyl]pyrrolidin-3-yl]-2-[1-(6-methylpyridazine-3-carbonyl)-4-piperidylidene]acetamide
Molecular Mass 487.569 g·mol−1
Heat of Formation -168.9 ± 16.7 kJ·mol−1
Dipole Moment 6.19 ± 1.08 D
Volume 595.86 Å 3
Surface Area 435.17 Å 2
HOMO Energy -9.05 ± 0.55 eV
LUMO Energy -0.84 ± eV
Point Group Symmetry C1
Synonyms
  • n-[(3r)-1-[(6-fluoro-2-naphthyl)methyl]-3-pyrrolidinyl]-2-[1-[(6-methyl-3-pyridazinyl)-oxomethyl]-4-piperidinylidene]acetamide
  • n-[(3r)-1-[(6-fluoro-2-naphthyl)methyl]pyrrolidin-3-yl]-2-[1-(6-methylpyridazine-3-carbonyl)-4-piperidylidene]acetamide
  • n-[(3r)-1-[(6-fluoronaphthalen-2-yl)methyl]pyrrolidin-3-yl]-2-[1-(6-methylpyridazin-3-yl)carbonylpiperidin-4-ylidene]ethanamide
  • n-[(3r)-1-[(6-fluoronaphthalen-2-yl)methyl]pyrrolidin-3-yl]-2-[1-(6-methylpyridazine-3-carbonyl)piperidin-4-ylidene]acetamide
InChIKey OIXSYJAHIPQFMO-RUZDIDTESA-N
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