CAS 1220030-77-2

Piperidine, 3-[4-(1,1-dimethylethyl)-2-methylphenoxy]-, hydrochloride (1:1)

Description:

Piperidine, 3-[4-(1,1-dimethylethyl)-2-methylphenoxy]-, hydrochloride (1:1) is a chemical compound characterized by its piperidine ring structure, which is a six-membered saturated heterocycle containing one nitrogen atom. This compound features a phenoxy group substituted with a tert-butyl and a methyl group, contributing to its unique properties. As a hydrochloride salt, it is typically more soluble in water compared to its free base form, enhancing its utility in various applications, particularly in pharmaceutical contexts. The presence of the tert-butyl group may influence its lipophilicity and biological activity, making it relevant in drug design. The compound's molecular interactions can be significant in terms of receptor binding and pharmacodynamics. Safety and handling precautions are essential, as with many chemical substances, due to potential toxicity or reactivity. Overall, this compound exemplifies the complexity and diversity of organic chemistry, particularly in the realm of medicinal chemistry and compound synthesis.

Formula: C₁₆H₂₅NO·ClH

InChI: InChI=1S/C16H25NO.ClH/c1-12-10-13(16(2,3)4)7-8-15(12)18-14-6-5-9-17-11-14;/h7-8,10,14,17H,5-6,9,11H2,1-4H3;1H

InChI key: InChIKey=MWVKJOISDPBZAI-UHFFFAOYSA-N

SMILES: O(C1=C(C)C=C(C(C)(C)C)C=C1)C2CCCNC2.Cl

Synonyms:

• Piperidine, 3-[4-(1,1-dimethylethyl)-2-methylphenoxy]-, hydrochloride (1:1)