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CAS 211108-52-0

:

rel-1,1-Dimethylethyl (3R,4R)-3-fluoro-4-[(phenylmethyl)amino]-1-piperidinecarboxylate

Description:
Rel-1,1-Dimethylethyl (3R,4R)-3-fluoro-4-[(phenylmethyl)amino]-1-piperidinecarboxylate, identified by its CAS number 211108-52-0, is a chemical compound characterized by its piperidine core structure, which is a six-membered ring containing one nitrogen atom. This compound features a fluorine substituent at the 3-position and a phenylmethylamino group at the 4-position, contributing to its biological activity and potential pharmacological properties. The presence of the tert-butyl group (1,1-dimethylethyl) enhances its lipophilicity, which may influence its absorption and distribution in biological systems. The stereochemistry indicated by the (3R,4R) configuration suggests specific spatial arrangements of the substituents, which can significantly affect the compound's interaction with biological targets, such as receptors or enzymes. Overall, this compound may be of interest in medicinal chemistry for its potential therapeutic applications, although detailed studies would be necessary to elucidate its efficacy and safety profile.
Formula:C17H25FN2O2
InChI:InChI=1/C17H25FN2O2/c1-17(2,3)22-16(21)20-10-9-15(14(18)12-20)19-11-13-7-5-4-6-8-13/h4-8,14-15,19H,9-12H2,1-3H3/t14-,15-/s2
InChI key:InChIKey=JXBLMDWEOQDVAC-PTTDRDKLNA-N
SMILES:C(OC(C)(C)C)(=O)N1C[C@H](F)[C@@H](NCC2=CC=CC=C2)CC1
Synonyms:
  • rel-1,1-Dimethylethyl (3R,4R)-3-fluoro-4-[(phenylmethyl)amino]-1-piperidinecarboxylate
  • rel-(3R,4R)-4-Benzylamino-1-[tert-butoxycarbonyl]-3-fluoropiperidine
  • trans-tert-Butyl 4-(benzylamino)-3-fluoropiperidine-1-carboxylate
  • 1-Piperidinecarboxylic acid, 3-fluoro-4-[(phenylmethyl)amino]-, 1,1-dimethylethyl ester, (3R,4R)-rel-
  • 4-(Benzylamino)-3-fluoropiperidine-1-carboxylic acid trans-tert-butyl ester
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