CAS 1004304-12-4

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

Description:

1,1-Dimethylethyl 4-[(2-amino-3-fluorophenyl)amino]-1-piperidinecarboxylate, identified by its CAS number 1004304-12-4, is a chemical compound that features a piperidine ring, which is a six-membered nitrogen-containing heterocycle. This compound is characterized by the presence of a dimethyl group attached to the carbon chain, contributing to its steric bulk. The amino group on the phenyl ring indicates potential for hydrogen bonding and reactivity, while the fluorine substitution suggests enhanced lipophilicity and potential biological activity. The carboxylate functional group implies that the compound may exhibit acidic properties, influencing its solubility and interaction with biological systems. 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. Its specific properties, such as solubility, stability, and reactivity, would depend on the surrounding conditions and the presence of other functional groups.

Formula: C₁₆H₂₄FN₃O₂

InChI: InChI=1S/C16H24FN3O2/c1-16(2,3)22-15(21)20-9-7-11(8-10-20)19-13-6-4-5-12(17)14(13)18/h4-6,11,19H,7-10,18H2,1-3H3

InChI key: InChIKey=TXSTZSAIPQLNTF-UHFFFAOYSA-N

SMILES: N(C1=C(N)C(F)=CC=C1)C2CCN(C(OC(C)(C)C)=O)CC2

Synonyms:

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

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

CAS: 1004304-12-4

Formula: C₁₆H₂₄FN₃O₂

Purity: 95.0%

Molecular weight: 309.385

Ref: 10-F063616