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CAS 1289386-27-1

:

1,1-Dimethylethyl 2-methyl-4-[1-(2-pyridinyl)ethyl]-1-piperazinecarboxylate

Description:
1,1-Dimethylethyl 2-methyl-4-[1-(2-pyridinyl)ethyl]-1-piperazinecarboxylate, identified by its CAS number 1289386-27-1, is a chemical compound that belongs to the class of piperazine derivatives. This substance features a piperazine ring, which is a six-membered heterocyclic structure containing two nitrogen atoms. The presence of the 1,1-dimethylethyl group contributes to its steric bulk, potentially influencing its biological activity and solubility. The compound also contains a pyridine moiety, which may enhance its interaction with biological targets due to the nitrogen atom in the aromatic ring. Its carboxylate functional group suggests potential for forming salts or participating in esterification reactions. The overall structure indicates that it may exhibit pharmacological properties, making it of interest in medicinal chemistry. However, specific data regarding its physical properties, such as melting point, boiling point, and solubility, would require further investigation or experimental determination. Safety and handling information should also be consulted, as with any chemical substance.
Formula:C17H27N3O2
InChI:InChI=1S/C17H27N3O2/c1-13-12-19(14(2)15-8-6-7-9-18-15)10-11-20(13)16(21)22-17(3,4)5/h6-9,13-14H,10-12H2,1-5H3
InChI key:InChIKey=WGIOAFJQUPMPKY-UHFFFAOYSA-N
SMILES:C(OC(C)(C)C)(=O)N1C(C)CN(C(C)C2=CC=CC=N2)CC1
Synonyms:
  • 1,1-Dimethylethyl 2-methyl-4-[1-(2-pyridinyl)ethyl]-1-piperazinecarboxylate
  • 1-Piperazinecarboxylic acid, 2-methyl-4-[1-(2-pyridinyl)ethyl]-, 1,1-dimethylethyl ester
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