CAS 887582-66-3

1-Piperidinecarboxylicacid, 4-[[[3-(trifluoromethyl)phenyl]amino]methyl]-, 1,1-dimethylethyl ester

Description:

1-Piperidinecarboxylic acid, 4-[[[3-(trifluoromethyl)phenyl]amino]methyl]-, 1,1-dimethylethyl ester, identified by CAS number 887582-66-3, is a chemical compound characterized by its piperidine ring structure, which contributes to its basicity and potential for forming hydrogen bonds. The presence of a trifluoromethyl group enhances its lipophilicity and may influence its biological activity, making it a subject of interest in medicinal chemistry. The ester functional group indicates that it can undergo hydrolysis, potentially releasing the corresponding carboxylic acid and alcohol. This compound may exhibit specific pharmacological properties, possibly acting as an inhibitor or modulator in various biochemical pathways. Its structural complexity suggests potential applications in drug development, particularly in targeting specific receptors or enzymes. As with many organic compounds, its solubility, stability, and reactivity will depend on the surrounding conditions, including pH and temperature. Safety and handling precautions should be observed due to the presence of fluorinated groups, which can impart unique toxicological profiles.

Formula: C₁₈H₂₅F₃N₂O₂

InChI: InChI=1S/C18H25F3N2O2/c1-17(2,3)25-16(24)23-9-7-13(8-10-23)12-22-15-6-4-5-14(11-15)18(19,20)21/h4-6,11,13,22H,7-10,12H2,1-3H3

InChI key: InChIKey=OYCJYFCBQCJNKK-UHFFFAOYSA-N

SMILES: N(CC1CCN(C(OC(C)(C)C)=O)CC1)C2=CC(C(F)(F)F)=CC=C2

Synonyms:

• 1,1-Dimethylethyl 4-[[[3-(trifluoromethyl)phenyl]amino]methyl]-1-piperidinecarboxylate
• 1-Boc-4-[(3-Trifluoromethyl-Phenylamino)-Methyl]-Piperidine
• 1-Piperidinecarboxylic acid, 4-[[[3-(trifluoromethyl)phenyl]amino]methyl]-, 1,1-dimethylethyl ester