Cas no 1332608-95-3 ((1,4-Dimethyl-1H-pyrazol-3-yl)methanamine)

(1,4-Dimethyl-1H-pyrazol-3-yl)methanamine is a pyrazole-derived amine compound with potential applications in pharmaceutical and agrochemical research. Its structure features a methyl-substituted pyrazole core with an aminomethyl functional group, offering versatility as a building block in organic synthesis. The compound's well-defined molecular framework allows for precise modifications, making it valuable in the development of biologically active molecules. Its stability under standard conditions and compatibility with common reaction conditions enhance its utility in medicinal chemistry. Researchers may explore its use in designing enzyme inhibitors or ligand scaffolds due to its balanced lipophilicity and hydrogen-bonding capacity. The compound is typically supplied with high purity, ensuring reproducibility in experimental applications.
(1,4-Dimethyl-1H-pyrazol-3-yl)methanamine structure
1332608-95-3 structure
Product Name:(1,4-Dimethyl-1H-pyrazol-3-yl)methanamine
CAS No:1332608-95-3
MF:C6H11N3
MW:125.171640634537
CID:4695185
Update Time:2025-06-13

(1,4-Dimethyl-1H-pyrazol-3-yl)methanamine Chemical and Physical Properties

Names and Identifiers

    • (1,4-Dimethyl-1H-pyrazol-3-yl)methanamine
    • C-(1,4-Dimethyl-1H-pyrazol-3-yl)-methylamine
    • Inchi: 1S/C6H11N3/c1-5-4-9(2)8-6(5)3-7/h4H,3,7H2,1-2H3
    • InChI Key: AXACLKOUNGBFMU-UHFFFAOYSA-N
    • SMILES: N1(C)C=C(C)C(CN)=N1

Computed Properties

  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 1
  • Complexity: 94.3
  • Topological Polar Surface Area: 43.8

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Additional information on (1,4-Dimethyl-1H-pyrazol-3-yl)methanamine

Introduction to (1,4-Dimethyl-1H-pyrazol-3-yl)methanamine (CAS No. 1332608-95-3)

(1,4-Dimethyl-1H-pyrazol-3-yl)methanamine is a significant compound in the field of pharmaceutical chemistry, characterized by its unique structural and functional properties. This compound, identified by its CAS number 1332608-95-3, has garnered attention due to its potential applications in drug discovery and development. The molecular structure of this compound includes a pyrazole ring substituted with two methyl groups at the 1 and 4 positions, and an amine group at the 3 position, which contributes to its distinct chemical behavior and reactivity.

The pyrazole core is a heterocyclic aromatic compound that is widely recognized for its biological activity. Pyrazole derivatives have been extensively studied for their role in various pharmacological applications, including antiviral, anti-inflammatory, and anticancer agents. The presence of methyl groups at the 1 and 4 positions enhances the lipophilicity of the molecule, making it more soluble in organic solvents and potentially improving its bioavailability when administered orally or topically.

The amine group at the 3 position of the pyrazole ring introduces basicity to the molecule, which can be exploited in various chemical reactions such as nucleophilic substitution or condensation reactions. This feature makes (1,4-Dimethyl-1H-pyrazol-3-yl)methanamine a versatile intermediate in synthetic chemistry, particularly in the preparation of more complex molecules with tailored biological activities.

Recent research has highlighted the potential of pyrazole derivatives as scaffolds for developing novel therapeutic agents. For instance, studies have demonstrated that certain pyrazole-based compounds exhibit inhibitory effects on enzymes involved in inflammatory pathways, making them promising candidates for treating chronic inflammatory diseases. Additionally, modifications of the pyrazole ring have been explored to enhance binding affinity to target proteins, which is crucial for developing more effective drugs.

In the context of drug development, (1,4-Dimethyl-1H-pyrazol-3-yl)methanamine has been investigated for its potential role as a precursor in synthesizing more complex pharmacophores. The compound's ability to undergo various chemical transformations allows researchers to modify its structure systematically, enabling the exploration of different biological activities. This flexibility is particularly valuable in medicinal chemistry, where iterative design and optimization are essential for identifying lead compounds with desired therapeutic properties.

The synthesis of (1,4-Dimethyl-1H-pyrazol-3-yl)methanamine involves multi-step organic reactions that require careful control of reaction conditions to ensure high yield and purity. Common synthetic routes include condensation reactions between appropriate precursors followed by functional group transformations. Advances in synthetic methodologies have enabled more efficient and scalable production of this compound, facilitating its use in both academic research and industrial applications.

The biological activity of (1,4-Dimethyl-1H-pyrazol-3-yl)methanamine has been explored through various in vitro and in vivo studies. Preliminary findings suggest that this compound may exhibit interactions with biological targets relevant to neurological disorders, cancer, and infectious diseases. These interactions are being further investigated to understand the mechanisms of action and potential therapeutic benefits. The compound's unique structural features make it a valuable tool for studying enzyme inhibition and receptor binding interactions.

In conclusion, (1,4-Dimethyl-1H-pyrazol-3-yl)methanamine (CAS No. 1332608-95-3) is a compound of considerable interest in pharmaceutical research due to its structural complexity and potential biological activities. Its role as an intermediate in synthetic chemistry and a precursor for developing novel therapeutic agents underscores its importance in drug discovery efforts. Continued investigation into this compound is expected to yield new insights into its pharmacological properties and applications.

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