Cas no 1423031-16-6 (1-(pyrimidin-2-yl)methanamine dihydrochloride)

1-(Pyrimidin-2-yl)methanamine dihydrochloride is a chemically stable, high-purity compound primarily used as a versatile intermediate in pharmaceutical and agrochemical synthesis. Its pyrimidine core structure makes it valuable for constructing biologically active molecules, particularly in the development of kinase inhibitors and antimicrobial agents. The dihydrochloride salt form enhances solubility, facilitating its use in aqueous reaction systems. This compound is characterized by consistent batch-to-batch quality, ensuring reliable performance in research and industrial applications. Its well-defined reactivity profile allows for selective functionalization, enabling efficient derivatization in multi-step synthetic routes. Suitable for controlled environments, it is typically supplied with detailed analytical documentation, including HPLC and NMR data, to support rigorous quality control standards.
1-(pyrimidin-2-yl)methanamine dihydrochloride structure
1423031-16-6 structure
Product Name:1-(pyrimidin-2-yl)methanamine dihydrochloride
CAS No:1423031-16-6
MF:C5H9Cl2N3
MW:182.051058530807
CID:4598323
PubChem ID:71756671
Update Time:2025-05-20

1-(pyrimidin-2-yl)methanamine dihydrochloride Chemical and Physical Properties

Names and Identifiers

    • pyrimidin-2-ylmethanamine dihydrochloride
    • pyrimidin-2-ylmethanamine 2HCl
    • SB56035
    • pyrimidin-2-ylmethanamine;dihydrochloride
    • 2-Pyrimidinemethanamine, hydrochloride (1:2)
    • 1-(pyrimidin-2-yl)methanamine dihydrochloride
    • Inchi: 1S/C5H7N3.2ClH/c6-4-5-7-2-1-3-8-5;;/h1-3H,4,6H2;2*1H
    • InChI Key: AQTAWMYRWLBOMP-UHFFFAOYSA-N
    • SMILES: Cl.Cl.N1C=CC=NC=1CN

Computed Properties

  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 1
  • Complexity: 58.7
  • Topological Polar Surface Area: 51.8

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Additional information on 1-(pyrimidin-2-yl)methanamine dihydrochloride

Comprehensive Overview of 1-(pyrimidin-2-yl)methanamine dihydrochloride (CAS No. 1423031-16-6): Properties, Applications, and Research Insights

1-(pyrimidin-2-yl)methanamine dihydrochloride (CAS No. 1423031-16-6) is a specialized organic compound that has garnered significant attention in pharmaceutical and biochemical research. This compound, characterized by its pyrimidine core and dihydrochloride salt form, serves as a versatile building block in drug discovery and material science. Its unique structural features, including the amine functional group, make it a valuable intermediate for synthesizing more complex molecules. Researchers and industry professionals frequently search for terms like "pyrimidine derivatives in drug development" or "amine-based pharmaceutical intermediates", reflecting the growing demand for such compounds in modern science.

The chemical properties of 1-(pyrimidin-2-yl)methanamine dihydrochloride are closely tied to its molecular structure. The pyrimidine ring is a heterocyclic aromatic system, similar to pyridine, which contributes to its stability and reactivity. This compound is particularly noted for its solubility in water and polar solvents, a trait enhanced by its dihydrochloride form. Such properties are critical for applications in aqueous-phase reactions, a topic often explored in queries like "water-soluble amine compounds" or "pyrimidine solubility in drug formulations". These characteristics align with current trends in green chemistry, where researchers prioritize environmentally friendly solvents.

In the realm of pharmaceuticals, 1-(pyrimidin-2-yl)methanamine dihydrochloride is frequently employed as a precursor in the synthesis of active pharmaceutical ingredients (APIs). Its pyrimidine scaffold is a common motif in drugs targeting neurological disorders, infections, and metabolic diseases. Recent studies highlight its potential in developing kinase inhibitors, a hot topic in cancer research. Searches for "pyrimidine-based kinase inhibitors" or "small molecule drug discovery 2023" underscore the relevance of this compound in cutting-edge therapeutic development. The dihydrochloride form further enhances its utility by improving bioavailability, a key consideration in modern drug design.

Beyond pharmaceuticals, 1-(pyrimidin-2-yl)methanamine dihydrochloride finds applications in agrochemical research and material science. The pyrimidine moiety is a key component in certain pesticides and herbicides, addressing the increasing demand for crop protection solutions. Queries such as "heterocyclic compounds in agriculture" or "pyrimidine derivatives for crop yield" reflect this application's significance. Additionally, its structural properties make it a candidate for designing advanced materials, including organic semiconductors and metal-organic frameworks (MOFs), areas gaining traction in sustainable technology discussions.

Quality control and synthesis optimization of 1-(pyrimidin-2-yl)methanamine dihydrochloride are critical for ensuring reproducibility in research and industrial settings. Analytical techniques like HPLC, NMR, and mass spectrometry are routinely used to verify its purity, a subject often searched as "CAS 1423031-16-6 purity analysis" or "pyrimidine amine characterization methods". The compound's stability under various conditions is another focal point, with researchers investigating optimal storage protocols to maintain its efficacy over time.

The future prospects of 1-(pyrimidin-2-yl)methanamine dihydrochloride are closely tied to advancements in combinatorial chemistry and high-throughput screening. As the pharmaceutical industry shifts toward personalized medicine, the demand for tailored pyrimidine derivatives is expected to rise. Emerging trends like "AI-assisted molecular design" and "fragment-based drug discovery" further highlight the compound's potential in next-generation therapeutics. Its role in addressing global health challenges, such as antimicrobial resistance, positions it as a compound of enduring scientific and industrial relevance.

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