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CAS 1780781-02-3

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tert-butyl 1-amino-3-azabicyclo[3.2.1]octane-3-carboxylate

Description:
Tert-butyl 1-amino-3-azabicyclo[3.2.1]octane-3-carboxylate is a chemical compound characterized by its bicyclic structure, which includes a nitrogen atom within the ring system, contributing to its classification as an azabicyclic compound. The presence of the tert-butyl group enhances its lipophilicity, potentially influencing its solubility and biological activity. The amino group indicates that it can participate in hydrogen bonding, which may affect its reactivity and interactions with biological targets. The carboxylate functional group suggests that the compound can exist in both protonated and deprotonated forms, depending on the pH of the environment, which can impact its pharmacokinetic properties. This compound may be of interest in medicinal chemistry due to its structural features that could lead to specific interactions with biological molecules, making it a candidate for further research in drug development. Its unique bicyclic framework and functional groups may also provide avenues for synthetic modifications to enhance its efficacy or selectivity in therapeutic applications.
Formula:C12H22N2O2
InChI:InChI=1S/C12H22N2O2/c1-11(2,3)16-10(15)14-7-9-4-5-12(13,6-9)8-14/h9H,4-8,13H2,1-3H3
InChI key:LUKNMMRQVQVREC-UHFFFAOYSA-N
SMILES:CC(C)(C)OC(=O)N1CC2CCC(C2)(C1)N
Synonyms:
  • 3-Azabicyclo[3.2.1]octane-3-carboxylic acid, 1-amino-, 1,1-dimethylethyl este
  • tert-butyl 1-amino-3-azabicyclo[3.2.1]octane-3-carboxylate
  • 3-Azabicyclo[3.2.1]octane-3-carboxylic acid, 1-amino-, 1,1-dimethylethyl ester
  • tert-butyl 5-amino-3-azabicyclo[3.2.1]octane-3-carboxylate
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