Cas no 875551-76-1 (tert-butyl N-(piperazin-2-yl)methylcarbamate)

Tert-butyl N-(piperazin-2-yl)methylcarbamate is a protected piperazine derivative commonly used as an intermediate in organic synthesis and pharmaceutical research. Its key advantage lies in the tert-butyloxycarbonyl (Boc) protecting group, which enhances stability and facilitates selective reactions under mild conditions. The compound’s piperazine core offers versatility in constructing biologically active molecules, particularly in drug discovery for CNS and antimicrobial agents. Its well-defined reactivity allows for efficient deprotection and further functionalization, making it valuable for peptide synthesis and heterocyclic chemistry. The Boc group also improves solubility and handling characteristics, ensuring compatibility with a range of reaction conditions. This compound is widely utilized in medicinal chemistry due to its reliability and synthetic utility.
tert-butyl N-(piperazin-2-yl)methylcarbamate structure
875551-76-1 structure
Product Name:tert-butyl N-(piperazin-2-yl)methylcarbamate
CAS No:875551-76-1
MF:C10H21N3O2
MW:215.292642354965
MDL:MFCD11655980
CID:1120165
PubChem ID:59003263
Update Time:2025-05-27

tert-butyl N-(piperazin-2-yl)methylcarbamate Chemical and Physical Properties

Names and Identifiers

    • (2-piperazinylmethyl)-Carbamic acid 1,1-dimethylethyl ester
    • tert-butyl N-(piperazin-2-yl)methylcarbamate
    • 875551-76-1
    • N-Boc-1-(2-piperazinyl)methanamine
    • EN300-25420840
    • MFCD11655980
    • SCHEMBL12496309
    • SY287051
    • tert-butyl N-[(piperazin-2-yl)methyl]carbamate
    • CS-0457698
    • tert-butyl (piperazin-2-ylmethyl)carbamate
    • TERT-BUTYL N-(PIPERAZIN-2-YLMETHYL)CARBAMATE
    • MDL: MFCD11655980
    • Inchi: 1S/C10H21N3O2/c1-10(2,3)15-9(14)13-7-8-6-11-4-5-12-8/h8,11-12H,4-7H2,1-3H3,(H,13,14)
    • InChI Key: XWVBNGQHXQOIBF-UHFFFAOYSA-N
    • SMILES: O(C(NCC1CNCCN1)=O)C(C)(C)C

Computed Properties

  • Exact Mass: 215.16337692g/mol
  • Monoisotopic Mass: 215.16337692g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 4
  • Complexity: 213
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -0.1
  • Topological Polar Surface Area: 62.4?2

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Additional information on tert-butyl N-(piperazin-2-yl)methylcarbamate

Comprehensive Overview of tert-butyl N-(piperazin-2-yl)methylcarbamate (CAS No. 875551-76-1)

tert-butyl N-(piperazin-2-yl)methylcarbamate (CAS No. 875551-76-1) is a specialized organic compound widely utilized in pharmaceutical research and fine chemical synthesis. This compound, often referred to by its systematic name or CAS number, plays a pivotal role in the development of novel drug candidates, particularly in the fields of central nervous system (CNS) therapeutics and enzyme inhibitors. Its unique structural features, including the piperazine ring and tert-butyl carbamate group, make it a versatile intermediate for medicinal chemistry applications.

In recent years, the demand for tert-butyl N-(piperazin-2-yl)methylcarbamate has surged due to its relevance in addressing modern healthcare challenges. Researchers are increasingly exploring its potential in neurodegenerative disease treatments, such as Alzheimer's and Parkinson's, where modulating neurotransmitter systems is critical. Additionally, its application in cancer drug discovery has gained traction, as piperazine derivatives are known to exhibit kinase inhibitory activity. These trends align with frequent search queries like "piperazine derivatives in drug development" and "CAS 875551-76-1 applications," reflecting growing scientific interest.

The synthesis of tert-butyl N-(piperazin-2-yl)methylcarbamate typically involves multi-step organic reactions, including Boc protection strategies and reductive amination processes. Its purity and stability are paramount for pharmaceutical use, driving advancements in analytical techniques such as HPLC and LC-MS for quality control. Industry professionals often search for "synthesis optimization of CAS 875551-76-1" or "Boc-protected piperazine derivatives," underscoring the need for efficient production methods.

From a regulatory perspective, tert-butyl N-(piperazin-2-yl)methylcarbamate complies with global standards for research chemicals, with no restrictions under major chemical control frameworks. This makes it accessible for academic and industrial laboratories focusing on peptide mimetics or small molecule drug design. Environmental considerations are also addressed through green chemistry approaches, responding to queries like "sustainable synthesis of piperazine intermediates."

Future prospects for this compound include its integration into combinatorial chemistry libraries and high-throughput screening platforms. As precision medicine advances, customized modifications of the piperazine scaffold may unlock new therapeutic avenues. The compound's relevance in GPCR-targeted drugs (G protein-coupled receptors) further positions it at the forefront of biopharmaceutical innovation, matching trending searches about "next-generation drug scaffolds."

In summary, tert-butyl N-(piperazin-2-yl)methylcarbamate (CAS No. 875551-76-1) represents a critical building block in contemporary drug discovery. Its adaptability to diverse medicinal chemistry applications and alignment with cutting-edge research priorities ensure its continued importance in scientific and industrial contexts. For researchers seeking reliable data, this compound exemplifies the intersection of chemical innovation and therapeutic potential.

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