CAS 1159976-33-6: 1,1-Dimethylethyl 4-[[(4-aminophenyl)amino]methyl]-1-piperidinecarboxylate

Description: 1,1-Dimethylethyl 4-[[(4-aminophenyl)amino]methyl]-1-piperidinecarboxylate, identified by its CAS number 1159976-33-6, 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 a tert-butyl group, contributing to its steric bulk. The structure includes an amino group linked to a phenyl ring, indicating potential for hydrogen bonding and interactions with biological targets. The carboxylate functional group suggests that it may exhibit acidic properties, influencing its solubility and reactivity in various environments. This compound may be of interest in medicinal chemistry due to its potential biological activity, particularly in the context of drug design and development. Its specific characteristics, such as melting point, boiling point, and solubility, would depend on the molecular interactions and the presence of functional groups, which can affect its behavior in different chemical contexts.

Formula: C₁₇H₂₇N₃O₂

InChI: InChI=1S/C17H27N3O2/c1-17(2,3)22-16(21)20-10-8-13(9-11-20)12-19-15-6-4-14(18)5-7-15/h4-7,13,19H,8-12,18H2,1-3H3

InChI key: InChIKey=JROBTSJMSGLWKV-UHFFFAOYSA-N

SMILES: O=C(OC(C)(C)C)N1CCC(CNC2=CC=C(N)C=C2)CC1

Synonyms:

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

4-[(4-Amino-phenylamino)-methyl]-piperidine-1-carboxylic acid tert-butyl ester

CAS: 1159976-33-6

• Molecular weight: 305.42g/mol

tert-Butyl 4-[(4-aminoanilino)methyl]piperidine-1-carboxylate

CAS: 1159976-33-6

Versatile small molecule scaffold

• Formula: C₁₇H₂₇N₃O₂
• Purity: Min. 95%
• Molecular weight: 305.4 g/mol