CAS 71274-39-0

N-[(Butylamino)carbonyl]-β-alanine

Description:

N-[(Butylamino)carbonyl]-β-alanine, with the CAS number 71274-39-0, is an amino acid derivative characterized by the presence of a butylamino group attached to the carbonyl carbon of β-alanine. This compound features both an amino group and a carboxylic acid group, typical of amino acids, which allows it to participate in various biochemical reactions. The butylamino substituent enhances its hydrophobic character, potentially influencing its solubility and interaction with biological membranes. The presence of the carbonyl group suggests that it may engage in hydrogen bonding, affecting its reactivity and stability. This compound may be of interest in pharmaceutical applications, particularly in the design of peptide-based drugs or as a building block in organic synthesis. Its structural properties may also allow it to act as a ligand in coordination chemistry or as a substrate in enzymatic reactions. Overall, N-[(Butylamino)carbonyl]-β-alanine exhibits characteristics typical of amino acid derivatives, with unique features imparted by its butylamino group.

Formula: C₈H₁₆N₂O₃

InChI: InChI=1S/C8H16N2O3/c1-2-3-5-9-8(13)10-6-4-7(11)12/h2-6H2,1H3,(H,11,12)(H2,9,10,13)

InChI key: InChIKey=VMNLKNWKYSIMHQ-UHFFFAOYSA-N

SMILES: C(NCCC(O)=O)(NCCCC)=O

Synonyms:

• β-Alanine, N-[(butylamino)carbonyl]-
• β-Alanine, N-(butylcarbamoyl)-
• 3-[(Butylcarbamoyl)amino]propanoic acid
• N-[(Butylamino)carbonyl]-β-alanine