1-Cyclopropyl-6-Fluoro-8-Methoxy-7-[(3R)-3-(Methylamino)-1-Piperidinyl]-4-Oxo-1,4-Dihydro-3-Quinolinecarboxylic Acid

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Properties Simple | Detailed

Formula C20H33FN3O4+
IUPAC Name 1-cyclopropyl-6-fluoro-8-methoxy-7-[(1s,3r)-3-(methylamino)-1-piperidyl]-4-oxo-2,5-dihydroquinoline-2,3,4a,5,6,7,8,8a-octaide-3-carboxylic acid
Molecular Mass 398.492 g·mol−1
Heat of Formation -590.4 ± 16.7 kJ·mol−1
Dipole Moment 9.40 ± 1.08 D
Volume 450.77 Å 3
Surface Area 375.14 Å 2
HOMO Energy -8.75 ± 0.55 eV
LUMO Energy 2.12 ± eV
Point Group Symmetry C1
Synonyms
  • 1-cyclopropyl-6-fluoro-4-keto-8-methoxy-7-[(3r)-3-methylamino-1-piperidyl]quinoline-3-carboxylic acid
  • 1-cyclopropyl-6-fluoro-8-methoxy-7-[(3r)-3-methylamino-1-piperidinyl]-4-oxo-3-quinolinecarboxylic acid
  • 1-cyclopropyl-6-fluoro-8-methoxy-7-[(3r)-3-methylamino-1-piperidyl]-4-oxo-quinoline-3-carboxylic acid
  • 1-cyclopropyl-6-fluoro-8-methoxy-7-[(3r)-3-methylaminopiperidin-1-yl]-4-oxo-quinoline-3-carboxylic acid
  • 1-cyclopropyl-6-fluoro-8-methoxy-7-[(3r)-3-methylaminopiperidin-1-yl]-4-oxoquinoline-3-carboxylic acid
InChIKey MGQLHRYJBWGORO-LLVKDONJSA-N
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