structure of Tert-butyl 3-aminopiperidine-1-carboxylate hydrochloride

Tert-butyl 3-aminopiperidine-1-carboxylate hydrochloride

CAS No.: 1000796-62-2
M. Wt: 236.73900
M. Fa: C10H21ClN2O2
InChI Key: DUNAVVRRZJQGCZ-UHFFFAOYSA-N
Appearance: Solid

Names and Identifiers of 1000796-62-2

CAS Number

1000796-62-2

EC Number

811-389-9

MDL Number

MFCD06691424

IUPAC Name

tert-butyl 3-aminopiperidine-1-carboxylate;hydrochloride

InChI

InChI=1S/C10H20N2O2.ClH/c1-10(2,3)14-9(13)12-6-4-5-8(11)7-12;/h8H,4-7,11H2,1-3H3;1H

InChIKey

DUNAVVRRZJQGCZ-UHFFFAOYSA-N

Canonical SMILES

CC(C)(C)OC(=O)N1CCCC(C1)N.Cl

UNSPSC Code

12352100

Physical and chemical properties of 1000796-62-2

Exact Mass

236.12900

LogP

2.78480

Molecular Formula

C10H21ClN2O2

Molecular Weight

236.73900

PSA

55.56000

Storage condition

under inert gas (nitrogen or Argon) at 2-8°C

Safety Information of 1000796-62-2

Pictograms

Signal Word

 Warning

Safety Data Sheet
Supports customized editing of SDS information and downloading in PDF documents.

Applications of 1000796-62-2

Tert-butyl 3-aminopiperidine-1-carboxylate hydrochloride finds applications primarily in medicinal chemistry:

  • Pharmaceutical Development: It serves as an intermediate in the synthesis of various bioactive compounds, particularly those targeting metabolic disorders.
  • Research: Used in studies related to enzyme inhibition and drug design due to its structural properties.

Interaction Studies of 1000796-62-2

Studies on the interactions of tert-butyl 3-aminopiperidine-1-carboxylate hydrochloride with biological targets have shown potential for developing therapeutic agents. It has been explored for its inhibitory effects on specific enzymes relevant to metabolic pathways, indicating its utility in drug discovery efforts aimed at treating conditions like diabetes and obesity.

Biological Activity of 1000796-62-2

Research indicates that tert-butyl 3-aminopiperidine-1-carboxylate hydrochloride exhibits biological activity relevant to pharmacology. It has been investigated for its potential as a precursor in the synthesis of inhibitors for various biological targets, including dipeptidyl peptidase IV, which is significant in diabetes management. The compound's structure suggests it may interact with biological systems through its amine and carboxylate functionalities.