CAS 1334491-82-5

1-(1,1-Dimethylethyl) 3-(4-carboxy-3-isoxazolyl)-1-piperidinecarboxylate

Description:

1-(1,1-Dimethylethyl) 3-(4-carboxy-3-isoxazolyl)-1-piperidinecarboxylate, identified by its CAS number 1334491-82-5, is a chemical compound characterized by its complex structure, which includes a piperidine ring substituted with both a tert-butyl group and a carboxy-isoxazole moiety. This compound exhibits properties typical of piperidine derivatives, such as potential biological activity, which may include interactions with various receptors or enzymes. The presence of the isoxazole ring suggests potential applications in medicinal chemistry, particularly in the development of pharmaceuticals, due to its ability to participate in hydrogen bonding and π-π interactions. Additionally, the carboxylic acid functional group may enhance solubility and reactivity, making it a candidate for further chemical modifications. Overall, this compound's unique structural features contribute to its potential utility in research and development within the fields of organic and medicinal chemistry.

Formula: C₁₄H₂₀N₂O₅

InChI: InChI=1S/C14H20N2O5/c1-14(2,3)21-13(19)16-6-4-5-9(7-16)11-10(12(17)18)8-20-15-11/h8-9H,4-7H2,1-3H3,(H,17,18)

InChI key: InChIKey=XRMMKKJZGRQYTF-UHFFFAOYSA-N

SMILES: C(O)(=O)C=1C(=NOC1)C2CN(C(OC(C)(C)C)=O)CCC2

Synonyms:

• 1-Piperidinecarboxylic acid, 3-(4-carboxy-3-isoxazolyl)-, 1-(1,1-dimethylethyl) ester
• 1-(1,1-Dimethylethyl) 3-(4-carboxy-3-isoxazolyl)-1-piperidinecarboxylate