CAS 1261233-30-0

1,1-Dimethylethyl 3-[(2-chloro-4-pyrimidinyl)methylamino]-1-piperidinecarboxylate

Description:

1,1-Dimethylethyl 3-[(2-chloro-4-pyrimidinyl)methylamino]-1-piperidinecarboxylate, identified by its CAS number 1261233-30-0, is a chemical compound characterized by its complex structure, which includes a piperidine ring and a pyrimidine moiety. This compound features a tert-butyl group (1,1-dimethylethyl) that contributes to its steric bulk, potentially influencing its biological activity and solubility. The presence of the chloro substituent on the pyrimidine ring may enhance its reactivity and interaction with biological targets. The methylamino group attached to the pyrimidine suggests potential for hydrogen bonding, which can be critical in drug design and interactions with receptors. As a carboxylate ester, it may exhibit properties typical of esters, such as volatility and susceptibility to hydrolysis. Overall, this compound's unique structural features suggest potential applications in medicinal chemistry, particularly in the development of pharmaceuticals targeting specific biological pathways. However, detailed studies would be necessary to fully elucidate its properties and potential uses.

Formula: C₁₅H₂₃ClN₄O₂

InChI: InChI=1S/C15H23ClN4O2/c1-15(2,3)22-14(21)20-9-5-6-11(10-20)19(4)12-7-8-17-13(16)18-12/h7-8,11H,5-6,9-10H2,1-4H3

InChI key: InChIKey=GQMIPFLYXXVUBC-UHFFFAOYSA-N

SMILES: N(C)(C1CN(C(OC(C)(C)C)=O)CCC1)C2=NC(Cl)=NC=C2

Synonyms:

• 1-Piperidinecarboxylic acid, 3-[(2-chloro-4-pyrimidinyl)methylamino]-, 1,1-dimethylethyl ester
• 1,1-Dimethylethyl 3-[(2-chloro-4-pyrimidinyl)methylamino]-1-piperidinecarboxylate