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CAS 887587-44-2

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1,1-Dimethylethyl 3-[[(4-fluorophenyl)amino]methyl]-1-piperidinecarboxylate

Description:
1,1-Dimethylethyl 3-[[(4-fluorophenyl)amino]methyl]-1-piperidinecarboxylate, identified by its CAS number 887587-44-2, is a chemical compound that belongs to the class of piperidine derivatives. This substance features a piperidine ring, which is a six-membered nitrogen-containing heterocycle, and is substituted with a carboxylate group and a dimethyl group, contributing to its steric properties. The presence of a 4-fluorophenyl group indicates that it has potential applications in medicinal chemistry, particularly in the development of pharmaceuticals, due to the influence of fluorine on biological activity and lipophilicity. The compound's structure suggests it may exhibit interesting interactions with biological targets, making it a candidate for further research in drug discovery. Additionally, the presence of both aliphatic and aromatic components in its structure may influence its solubility and reactivity. As with many organic compounds, its stability, reactivity, and potential applications would depend on specific environmental conditions and the presence of other chemical entities.
Formula:C17H25FN2O2
InChI:InChI=1S/C17H25FN2O2/c1-17(2,3)22-16(21)20-10-4-5-13(12-20)11-19-15-8-6-14(18)7-9-15/h6-9,13,19H,4-5,10-12H2,1-3H3
InChI key:InChIKey=FIZMISDRFODYSK-UHFFFAOYSA-N
SMILES:C(NC1=CC=C(F)C=C1)C2CN(C(OC(C)(C)C)=O)CCC2
Synonyms:
  • 1,1-Dimethylethyl 3-[[(4-fluorophenyl)amino]methyl]-1-piperidinecarboxylate
  • 1-Boc-3-[(4-Fluoro-Phenylamino)-Methyl]-Piperidine
  • 1-Piperidinecarboxylic acid, 3-[[(4-fluorophenyl)amino]methyl]-, 1,1-dimethylethyl ester
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