CAS 852857-11-5

rel-Methyl (3R)-5-oxo-1-[(1R)-1-phenylethyl]-3-pyrrolidinecarboxylate

Description:

Rel-Methyl (3R)-5-oxo-1-[(1R)-1-phenylethyl]-3-pyrrolidinecarboxylate, with the CAS number 852857-11-5, is a chemical compound characterized by its pyrrolidine ring structure, which is a five-membered nitrogen-containing heterocycle. This compound features a methyl ester functional group, contributing to its reactivity and solubility properties. The presence of a phenylethyl substituent indicates potential for interactions with biological systems, making it of interest in medicinal chemistry. The specific stereochemistry, denoted by the (3R) and (1R) configurations, suggests that the compound may exhibit chiral properties, which can influence its pharmacological activity and interactions with biological targets. Additionally, the oxo group (carbonyl) enhances the compound's reactivity, potentially allowing for further chemical modifications. Overall, this compound's unique structural features may contribute to its potential applications in drug development or as a synthetic intermediate in organic chemistry.

Formula: C₁₄H₁₇NO₃

InChI: InChI=1/C14H17NO3/c1-10(11-6-4-3-5-7-11)15-9-12(8-13(15)16)14(17)18-2/h3-7,10,12H,8-9H2,1-2H3/t10-,12-/s2

InChI key: InChIKey=BENQIPNJLDAXAT-DWEIKOLQNA-N

SMILES: [C@H](C)(N1C(=O)C[C@@H](C(OC)=O)C1)C2=CC=CC=C2

Synonyms:

• 3-Pyrrolidinecarboxylic acid, 5-oxo-1-[(1R)-1-phenylethyl]-, methyl ester, (3R)-rel-
• rel-Methyl (3R)-5-oxo-1-[(1R)-1-phenylethyl]-3-pyrrolidinecarboxylate