CAS 426844-22-6

1,1-Dimethylethyl (2S,4S)-2-(aminocarbonyl)-4-fluoro-1-pyrrolidinecarboxylate

Description:

1,1-Dimethylethyl (2S,4S)-2-(aminocarbonyl)-4-fluoro-1-pyrrolidinecarboxylate, with CAS number 426844-22-6, is a chemical compound characterized by its pyrrolidine structure, which includes a fluorine atom and an aminocarbonyl group. This compound features a chiral center, indicated by the (2S,4S) configuration, which contributes to its potential biological activity and specificity in interactions. The presence of the dimethyl group enhances its steric properties, influencing its reactivity and solubility. As a carboxylate ester, it may exhibit properties typical of esters, such as being susceptible to hydrolysis under certain conditions. The fluorine substitution can impart unique electronic characteristics, potentially affecting the compound's pharmacokinetics and pharmacodynamics. Overall, this compound may be of interest in medicinal chemistry, particularly in the development of pharmaceuticals, due to its structural features that could interact with biological targets. However, specific applications and safety profiles would require further investigation and empirical data.

Formula: C₁₀H₁₇FN₂O₃

InChI: InChI=1S/C10H17FN2O3/c1-10(2,3)16-9(15)13-5-6(11)4-7(13)8(12)14/h6-7H,4-5H2,1-3H3,(H2,12,14)/t6-,7-/m0/s1

InChI key: InChIKey=SQGNCVVKJIZGLC-BQBZGAKWSA-N

SMILES: C(OC(C)(C)C)(=O)N1[C@H](C(N)=O)C[C@H](F)C1

Synonyms:

• (2S,4S)-2-(Aminocarbonyl)-1-tert-butoxycarbonyl-4-fluoropyrrolidine
• tert-Butyl (2S,4S)-2-aminocarbonyl-4-fluoro-1-pyrrolidinecarboxylate
• 1,1-Dimethylethyl (2S,4S)-2-(aminocarbonyl)-4-fluoro-1-pyrrolidinecarboxylate
• (2S,4S)-2-Carbamoyl-4-fluoropyrrolidine-1-carboxylic acid tert-butyl ester
• 1-Pyrrolidinecarboxylic acid, 2-(aminocarbonyl)-4-fluoro-, 1,1-dimethylethyl ester, (2S,4S)-

Pyrrolidine Impurity 16

CAS: 426844-22-6

Formula: C₁₀H₁₇FN₂O₃

Molecular weight: 232.26

Ref: 4Z-P-208032