Cas no 1039985-93-7 (N4-(2-Methoxyethyl)pyridine-3,4-diamine)

N4-(2-Methoxyethyl)pyridine-3,4-diamine is a versatile intermediate in organic synthesis, particularly valued for its role in the development of pharmaceuticals and specialty chemicals. The compound features a pyridine core substituted with amino and 2-methoxyethyl groups, enhancing its reactivity and solubility in polar solvents. Its structural properties make it useful in the synthesis of heterocyclic compounds, ligands, and bioactive molecules. The methoxyethyl moiety contributes to improved stability and controlled reactivity, facilitating precise modifications in complex synthetic pathways. This intermediate is commonly employed in medicinal chemistry research, where its functional groups enable efficient derivatization for drug discovery and development applications.
N4-(2-Methoxyethyl)pyridine-3,4-diamine structure
1039985-93-7 structure
Product Name:N4-(2-Methoxyethyl)pyridine-3,4-diamine
CAS No:1039985-93-7
MF:C8H13N3O
MW:167.208321332932
MDL:MFCD11186908
CID:2117061
PubChem ID:28318597
Update Time:2025-10-22

N4-(2-Methoxyethyl)pyridine-3,4-diamine Chemical and Physical Properties

Names and Identifiers

    • N4-(2-methoxyethyl)pyridine-3,4-diamine
    • 3,4-Pyridinediamine, N4-(2-methoxyethyl)-
    • N4-(2-Methoxyethyl)pyridine-3,4-diamine
    • MDL: MFCD11186908
    • Inchi: 1S/C8H13N3O/c1-12-5-4-11-8-2-3-10-6-7(8)9/h2-3,6H,4-5,9H2,1H3,(H,10,11)
    • InChI Key: XPQGGJHFUOMKTM-UHFFFAOYSA-N
    • SMILES: O(C)CCNC1C=CN=CC=1N

Computed Properties

  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 4
  • Complexity: 121
  • Topological Polar Surface Area: 60.2

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Additional information on N4-(2-Methoxyethyl)pyridine-3,4-diamine

Comprehensive Overview of N4-(2-Methoxyethyl)pyridine-3,4-diamine (CAS No. 1039985-93-7)

N4-(2-Methoxyethyl)pyridine-3,4-diamine (CAS No. 1039985-93-7) is a specialized organic compound that has garnered significant attention in pharmaceutical and chemical research due to its unique structural properties. This compound, often referred to as a pyridine derivative, features a methoxyethyl substituent at the N4 position, which enhances its solubility and reactivity. Researchers are particularly interested in its potential applications as a building block for drug discovery, especially in the development of kinase inhibitors and anticancer agents. Its molecular formula and precise structure make it a valuable candidate for medicinal chemistry studies.

In recent years, the demand for N4-(2-Methoxyethyl)pyridine-3,4-diamine has surged, driven by its role in high-throughput screening and combinatorial chemistry. The compound's ability to form stable intermediates makes it a preferred choice for synthesizing heterocyclic compounds, which are pivotal in modern drug design. Moreover, its low toxicity profile and biocompatibility have made it a subject of interest in bioconjugation and targeted therapy research. These attributes align with the growing trend of precision medicine, where researchers seek compounds with minimal side effects and high efficacy.

The synthesis of N4-(2-Methoxyethyl)pyridine-3,4-diamine involves multi-step organic reactions, including nucleophilic substitution and catalytic hydrogenation. Advanced techniques such as HPLC purification and NMR spectroscopy are employed to ensure its high purity, which is critical for pharmaceutical-grade applications. The compound's stability under various pH conditions further broadens its utility in formulation development, particularly for oral and injectable drugs. This versatility has positioned it as a key intermediate in the synthesis of bioactive molecules.

From an industrial perspective, N4-(2-Methoxyethyl)pyridine-3,4-diamine is increasingly used in contract research organizations (CROs) and API manufacturing. Its compatibility with green chemistry principles, such as reduced solvent usage and energy-efficient processes, aligns with the global push for sustainable chemical production. Additionally, its application in proteomics and genomics research has opened new avenues for studying cellular signaling pathways, making it a hot topic in biomedical conferences and scientific publications.

As the scientific community continues to explore the potential of N4-(2-Methoxyethyl)pyridine-3,4-diamine, its relevance in personalized medicine and drug repurposing cannot be overstated. The compound's structure-activity relationship (SAR) is a focal point for researchers aiming to optimize its pharmacological properties. With the rise of AI-driven drug discovery, computational models are being leveraged to predict its interactions with biological targets, further accelerating its adoption in preclinical studies. This intersection of chemistry and technology underscores its importance in the future of therapeutic innovation.

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