CAS 1233955-45-7

1,1-Dimethylethyl 4-[(2-fluorobenzoyl)amino]-1-piperidinecarboxylate

Description:

1,1-Dimethylethyl 4-[(2-fluorobenzoyl)amino]-1-piperidinecarboxylate, identified by its CAS number 1233955-45-7, is a chemical compound characterized by its complex structure, which includes a piperidine ring and a fluorobenzoyl group. This compound typically exhibits properties associated with both amides and esters due to the presence of the carboxylate moiety. It is likely to be a solid at room temperature, with potential applications in medicinal chemistry, particularly in the development of pharmaceuticals. The presence of the fluorine atom may enhance lipophilicity and metabolic stability, making it a candidate for drug design. Additionally, the dimethyl group contributes to steric hindrance, which can influence the compound's reactivity and interaction with biological targets. As with many organic compounds, its solubility, stability, and reactivity can vary significantly depending on the solvent and environmental conditions. Safety data should be consulted for handling and usage, as with any chemical substance.

Formula: C₁₇H₂₃FN₂O₃

InChI: InChI=1S/C17H23FN2O3/c1-17(2,3)23-16(22)20-10-8-12(9-11-20)19-15(21)13-6-4-5-7-14(13)18/h4-7,12H,8-11H2,1-3H3,(H,19,21)

InChI key: InChIKey=IVABZTXBTDYQEJ-UHFFFAOYSA-N

SMILES: C(NC1CCN(C(OC(C)(C)C)=O)CC1)(=O)C2=C(F)C=CC=C2

Synonyms:

• 1,1-Dimethylethyl 4-[(2-fluorobenzoyl)amino]-1-piperidinecarboxylate
• 1-Piperidinecarboxylic acid, 4-[(2-fluorobenzoyl)amino]-, 1,1-dimethylethyl ester
• tert-Butyl 4-(2-fluorobenzamido)piperidine-1-carboxylate