CAS 1353977-89-5

Carbamic acid, N-[1-(2-chloroacetyl)-4-piperidinyl]-N-ethyl-, 1,1-dimethylethyl ester

Description:

Carbamic acid, N-[1-(2-chloroacetyl)-4-piperidinyl]-N-ethyl-, 1,1-dimethylethyl ester, identified by CAS number 1353977-89-5, is a chemical compound that belongs to the class of carbamates. It features a piperidine ring, which contributes to its potential biological activity, particularly in pharmacological applications. The presence of a chloroacetyl group suggests that it may exhibit reactivity typical of acylating agents, potentially influencing its interaction with biological targets. The ester functional group indicates that it can undergo hydrolysis, which may affect its stability and bioavailability. This compound may be of interest in medicinal chemistry, particularly in the development of therapeutic agents, due to its structural characteristics that could confer specific pharmacodynamic properties. Additionally, the presence of the ethyl and tert-butyl groups may enhance lipophilicity, influencing its absorption and distribution in biological systems. As with many chemical substances, safety and handling precautions are essential, given the potential for toxicity associated with certain functional groups.

Formula: C₁₄H₂₅ClN₂O₃

InChI: InChI=1S/C14H25ClN2O3/c1-5-17(13(19)20-14(2,3)4)11-6-8-16(9-7-11)12(18)10-15/h11H,5-10H2,1-4H3

InChI key: InChIKey=VEPOIQWAGYGXHA-UHFFFAOYSA-N

SMILES: N(C(OC(C)(C)C)=O)(CC)C1CCN(C(CCl)=O)CC1

Synonyms:

• [1-(2-Chloro-acetyl)-piperidin-4-yl]-ethyl-carbamic acid tert-butyl ester
• tert-Butyl N-[1-(2-chloroacetyl)piperidin-4-yl]-N-ethylcarbamate
• Carbamic acid, N-[1-(2-chloroacetyl)-4-piperidinyl]-N-ethyl-, 1,1-dimethylethyl ester