CAS 943845-69-0

1,1-Dimethylethyl N-[(3S)-1-(1,1-dimethylethyl)-2-oxo-3-pyrrolidinyl]carbamate

Description:

1,1-Dimethylethyl N-[(3S)-1-(1,1-dimethylethyl)-2-oxo-3-pyrrolidinyl]carbamate, identified by its CAS number 943845-69-0, is a chemical compound characterized by its unique structure that includes a carbamate functional group and a pyrrolidine ring. This compound features two tert-butyl groups, which contribute to its steric bulk and influence its reactivity and solubility. The presence of the pyrrolidine moiety suggests potential biological activity, as pyrrolidine derivatives are often found in pharmaceuticals and agrochemicals. The stereochemistry indicated by the (3S) designation implies that the compound has specific spatial arrangements that can affect its interactions with biological targets. Additionally, the carbamate group can participate in hydrogen bonding, enhancing its solubility in polar solvents. Overall, this compound's structural features suggest it may have applications in medicinal chemistry or as a synthetic intermediate in organic synthesis, although specific biological or chemical properties would require further investigation.

Formula: C₁₃H₂₄N₂O₃

InChI: InChI=1S/C13H24N2O3/c1-12(2,3)15-8-7-9(10(15)16)14-11(17)18-13(4,5)6/h9H,7-8H2,1-6H3,(H,14,17)/t9-/m0/s1

InChI key: InChIKey=UBKHJGXLRSJQML-VIFPVBQESA-N

SMILES: N(C(OC(C)(C)C)=O)[C@@H]1C(=O)N(C(C)(C)C)CC1

Synonyms:

• Carbamic acid, N-[(3S)-1-(1,1-dimethylethyl)-2-oxo-3-pyrrolidinyl]-, 1,1-dimethylethyl ester
• 1,1-Dimethylethyl N-[(3S)-1-(1,1-dimethylethyl)-2-oxo-3-pyrrolidinyl]carbamate