CAS 1233952-80-1

1,1-Dimethylethyl 4-[[(2-amino-3-fluorophenyl)amino]methyl]-1-piperidinecarboxylate

Description:

1,1-Dimethylethyl 4-[[(2-amino-3-fluorophenyl)amino]methyl]-1-piperidinecarboxylate, identified by its CAS number 1233952-80-1, is a chemical compound characterized by its complex structure, which includes a piperidine ring and an amino-substituted aromatic system. This compound features a tert-butyl group (1,1-dimethylethyl) that contributes to its steric bulk, potentially influencing its biological activity and solubility. The presence of a fluorine atom in the aromatic ring may enhance lipophilicity and alter the electronic properties of the molecule, which can be significant in medicinal chemistry. The amino groups in the structure suggest potential for hydrogen bonding, which could affect its interaction with biological targets. Overall, this compound may exhibit interesting pharmacological properties, making it a candidate for further research in drug development or as a biochemical probe. However, specific data regarding its physical properties, reactivity, and biological activity would require empirical investigation or literature review for comprehensive understanding.

Formula: C₁₇H₂₆FN₃O₂

InChI: InChI=1S/C17H26FN3O2/c1-17(2,3)23-16(22)21-9-7-12(8-10-21)11-20-14-6-4-5-13(18)15(14)19/h4-6,12,20H,7-11,19H2,1-3H3

InChI key: InChIKey=SJNYKUZVFKDAJW-UHFFFAOYSA-N

SMILES: N(CC1CCN(C(OC(C)(C)C)=O)CC1)C2=C(N)C(F)=CC=C2

Synonyms:

• 1,1-Dimethylethyl 4-[[(2-amino-3-fluorophenyl)amino]methyl]-1-piperidinecarboxylate
• 1-Piperidinecarboxylic acid, 4-[[(2-amino-3-fluorophenyl)amino]methyl]-, 1,1-dimethylethyl ester

tert-Butyl 4-[(2-amino-3-fluorophenylamino)methyl]piperidine-1-carboxylate

CAS: 1233952-80-1

Formula: C₁₇H₂₆FN₃O₂

Purity: 95.0%

Molecular weight: 323.412

Ref: 10-F063655