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CAS 3939-01-3

:

3-Piperidinecarboxylic acid, 4-oxo-1-(phenylmethyl)-, methyl ester, hydrochloride (1:1)

Description:
3-Piperidinecarboxylic acid, 4-oxo-1-(phenylmethyl)-, methyl ester, hydrochloride (1:1), with the CAS number 3939-01-3, is a chemical compound characterized by its piperidine ring structure, which is a six-membered ring containing one nitrogen atom. This compound features a carboxylic acid moiety, an oxo group, and a phenylmethyl group, contributing to its potential biological activity. As a hydrochloride salt, it is typically more soluble in water compared to its free base form, enhancing its utility in pharmaceutical applications. The presence of the methyl ester group suggests that it may undergo hydrolysis to release the corresponding carboxylic acid, which can be relevant in metabolic processes. The compound may exhibit various pharmacological properties, making it of interest in medicinal chemistry. Its structural complexity allows for potential interactions with biological targets, which could be explored in drug development. However, specific biological activities and safety profiles would require further investigation through empirical studies.
Formula:C14H18ClNO3
InChI:InChI=1/C14H17NO3/c1-18-14(17)12-10-15(8-7-13(12)16)9-11-5-3-2-4-6-11/h2-6,12H,7-10H2,1H3/p+1/t12-/m0/s1
InChI key:InChIKey=BRADBAOVPACOQQ-UHFFFAOYSA-N
SMILES:C(OC)(=O)C1C(=O)CCN(CC2=CC=CC=C2)C1.Cl
Synonyms:
  • (3S)-1-benzyl-3-(methoxycarbonyl)-4-oxopiperidinium
  • 1-Benzyl-3-(methoxycarbonyl)-4-oxopiperidine monohydrochloride
  • 1-Benzyl-3-carbomethoxy-4-piperidone hydrochloride
  • 1-Benzyl-4-oxo-3-piperidinecarboxylic acid methyl ester monohydrochloride
  • 1-Benzyl-4-oxopiperidine-3-carboxylic acid methyl ester hydrochloride
  • 3-Piperidinecarboxylic acid, 4-oxo-1-(phenylmethyl)-, methyl ester, hydrochloride
  • 3-Piperidinecarboxylic acid, 4-oxo-1-(phenylmethyl)-, methyl ester, hydrochloride (1:1)
  • Methyl 1-benzyl-4-oxo-3-piperidine-carboxylate hydrochloride
  • Methyl 1-benzyl-4-oxo-3-piperidinecarboxylate hydrochloride
  • Nipecotic acid, 1-benzyl-4-oxo-, methyl ester, hydrochloride
  • See more synonyms
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