CAS 911298-13-0

rel-Phenylmethyl (2R,4S)-4-hydroxy-2-(trifluoromethyl)-1-piperidinecarboxylate

Description:

Rel-Phenylmethyl (2R,4S)-4-hydroxy-2-(trifluoromethyl)-1-piperidinecarboxylate, with the CAS number 911298-13-0, is a chemical compound characterized by its piperidine structure, which includes a hydroxyl group and a trifluoromethyl group. The presence of the trifluoromethyl group enhances its lipophilicity and may influence its biological activity, making it of interest in medicinal chemistry. The compound's stereochemistry, indicated by the (2R,4S) configuration, suggests specific spatial arrangements of its atoms, which can significantly affect its pharmacological properties and interactions with biological targets. As a carboxylate ester, it may exhibit properties typical of esters, such as volatility and reactivity with nucleophiles. This compound is likely to be studied for its potential applications in drug development, particularly in areas related to central nervous system disorders, given the structural features common in neuroactive compounds. Its synthesis and characterization would involve standard organic chemistry techniques, and its stability and reactivity would be influenced by the functional groups present.

Formula: C₁₄H₁₆F₃NO₃

InChI: InChI=1/C14H16F3NO3/c15-14(16,17)12-8-11(19)6-7-18(12)13(20)21-9-10-4-2-1-3-5-10/h1-5,11-12,19H,6-9H2/t11-,12+/s2

InChI key: InChIKey=NSRYBKKCIAXQKZ-WEUYFXHZNA-N

SMILES: C(OCC1=CC=CC=C1)(=O)N2[C@@H](C(F)(F)F)C[C@@H](O)CC2

Synonyms:

• rel-Phenylmethyl (2R,4S)-4-hydroxy-2-(trifluoromethyl)-1-piperidinecarboxylate
• 1-Piperidinecarboxylic acid, 4-hydroxy-2-(trifluoromethyl)-, phenylmethyl ester, (2R,4S)-rel-