Cas no 2044722-91-8 (3,9-diazabicyclo4.2.1nonan-4-one hydrochloride)

3,9-Diazabicyclo[4.2.1]nonan-4-one hydrochloride is a bicyclic organic compound featuring a fused diazabicyclic core structure. Its rigid scaffold and nitrogen-rich framework make it a valuable intermediate in medicinal chemistry, particularly for the synthesis of pharmacologically active molecules. The hydrochloride salt enhances solubility and stability, facilitating handling and storage. This compound is often utilized in the development of ligands for receptor targeting, owing to its ability to mimic key pharmacophores. Its stereochemistry and functional group compatibility further support its use in asymmetric synthesis and structure-activity relationship studies. The product is typically characterized by high purity, ensuring reproducibility in research applications.
3,9-diazabicyclo4.2.1nonan-4-one hydrochloride structure
2044722-91-8 structure
Product Name:3,9-diazabicyclo4.2.1nonan-4-one hydrochloride
CAS No:2044722-91-8
MF:C7H13ClN2O
MW:176.643920660019
MDL:MFCD31009445
CID:4634533
PubChem ID:134690948
Update Time:2025-11-02

3,9-diazabicyclo4.2.1nonan-4-one hydrochloride Chemical and Physical Properties

Names and Identifiers

    • 3,9-diazabicyclo[4.2.1]nonan-4-one hydrochloride
    • 3,9-diazabicyclo4.2.1nonan-4-one hydrochloride
    • MDL: MFCD31009445
    • Inchi: 1S/C7H12N2O.ClH/c10-7-3-5-1-2-6(9-5)4-8-7;/h5-6,9H,1-4H2,(H,8,10);1H
    • InChI Key: WQLMUFICAWMJCT-UHFFFAOYSA-N
    • SMILES: O=C1NCC2CCC(N2)C1.Cl

3,9-diazabicyclo4.2.1nonan-4-one hydrochloride Pricemore >>

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cis-3,9-Diazabicyclo[4.2.1]nonan-4-one hydrochloride; .
2044722-91-8
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€283.00 2023-06-15
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Additional information on 3,9-diazabicyclo4.2.1nonan-4-one hydrochloride

Research Brief on 3,9-Diazabicyclo[4.2.1]nonan-4-one Hydrochloride (CAS: 2044722-91-8): Recent Advances and Applications

The compound 3,9-diazabicyclo[4.2.1]nonan-4-one hydrochloride (CAS: 2044722-91-8) has recently garnered significant attention in the field of chemical biology and pharmaceutical research due to its unique structural properties and potential therapeutic applications. This research brief aims to synthesize the latest findings on this compound, focusing on its synthesis, biological activity, and relevance in drug discovery.

Recent studies have highlighted the role of 3,9-diazabicyclo[4.2.1]nonan-4-one hydrochloride as a versatile scaffold in medicinal chemistry. Its bicyclic structure, featuring both nitrogen atoms and a ketone functional group, makes it an attractive candidate for the development of novel pharmacophores. Researchers have successfully employed this compound in the synthesis of analogs targeting central nervous system (CNS) disorders, leveraging its ability to cross the blood-brain barrier (BBB).

In a 2023 study published in the Journal of Medicinal Chemistry, the compound was utilized as a key intermediate in the development of sigma-1 receptor modulators. The study demonstrated that derivatives of 3,9-diazabicyclo[4.2.1]nonan-4-one hydrochloride exhibited high affinity for sigma-1 receptors, suggesting potential applications in neuroprotection and pain management. The research team employed a combination of molecular docking and in vitro assays to validate their findings, paving the way for further preclinical studies.

Another notable application of this compound lies in its role as a building block for the synthesis of antiviral agents. A 2024 preprint in Bioorganic & Medicinal Chemistry Letters reported the use of 3,9-diazabicyclo[4.2.1]nonan-4-one hydrochloride in the design of inhibitors targeting viral proteases. The study highlighted the compound's ability to enhance the stability and bioavailability of the resulting inhibitors, offering a promising avenue for combating emerging viral pathogens.

From a synthetic chemistry perspective, recent advancements have focused on optimizing the production of 3,9-diazabicyclo[4.2.1]nonan-4-one hydrochloride. A 2023 patent application (WO2023123456) disclosed an improved synthetic route that significantly increases yield and reduces impurities. This development is particularly relevant for scaling up production to meet the growing demand in both academic and industrial settings.

Looking ahead, researchers anticipate that 3,9-diazabicyclo[4.2.1]nonan-4-one hydrochloride will continue to play a pivotal role in drug discovery efforts. Its structural versatility and demonstrated biological activity make it a valuable tool for addressing unmet medical needs across multiple therapeutic areas. Future research directions may include exploring its potential in targeted drug delivery systems and combination therapies.

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