Cas no 310436-79-4 (1-Amino-3-methyl-1H-pyrrole-2-carboxamide)

1-Amino-3-methyl-1H-pyrrole-2-carboxamide is a heterocyclic organic compound featuring a pyrrole core substituted with an amino group and a carboxamide functionality. This structure makes it a versatile intermediate in pharmaceutical and agrochemical synthesis, particularly for the development of biologically active molecules. Its reactive amino and carboxamide groups enable selective modifications, facilitating the construction of complex heterocyclic frameworks. The compound’s stability under standard conditions and compatibility with common synthetic methodologies enhance its utility in research and industrial applications. It is often employed in the synthesis of potential therapeutic agents, including kinase inhibitors and antimicrobial compounds, due to its ability to impart favorable pharmacokinetic properties.
1-Amino-3-methyl-1H-pyrrole-2-carboxamide structure
310436-79-4 structure
Product Name:1-Amino-3-methyl-1H-pyrrole-2-carboxamide
CAS No:310436-79-4
MF:C6H9N3O
MW:139.155160665512
MDL:MFCD12923528
CID:300675
PubChem ID:21945766
Update Time:2025-10-31

1-Amino-3-methyl-1H-pyrrole-2-carboxamide Chemical and Physical Properties

Names and Identifiers

    • 1-Amino-3-methyl-1H-pyrrole-2-carboxamide
    • 1-amino-3-methylpyrrole-2-carboxamide
    • 1H-Pyrrole-2-carboxamide,1-amino-3-methyl-
    • 1-amino-2-aminocarbonyl-3-methylpyrrole
    • 1-Amino-2-aminocarbonyl-3-methyl-pyrrole
    • AK100554
    • ANW-70130
    • CTK8C3465
    • KB-217730
    • SureCN4051027
    • SCHEMBL4051027
    • DTXSID20620547
    • 310436-79-4
    • SB62671
    • 1H-Pyrrole-2-carboxamide,1-amino-3-methyl-(9ci)
    • AKOS006361134
    • MDL: MFCD12923528
    • Inchi: 1S/C6H9N3O/c1-4-2-3-9(8)5(4)6(7)10/h2-3H,8H2,1H3,(H2,7,10)
    • InChI Key: FAYRYNBQRLFBMN-UHFFFAOYSA-N
    • SMILES: O=C(C1=C(C)C=CN1N)N

Computed Properties

  • Exact Mass: 139.07467
  • Monoisotopic Mass: 139.074561919g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 1
  • Complexity: 148
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 0.5
  • Topological Polar Surface Area: 74?2

Experimental Properties

  • PSA: 74.04

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Additional information on 1-Amino-3-methyl-1H-pyrrole-2-carboxamide

Introduction to 1-Amino-3-methyl-1H-pyrrole-2-carboxamide (CAS No. 310436-79-4)

1-Amino-3-methyl-1H-pyrrole-2-carboxamide (CAS No. 310436-79-4) is a versatile compound that has garnered significant attention in the fields of medicinal chemistry and pharmaceutical research. This compound, characterized by its unique structural features, has shown promising potential in various applications, particularly in the development of novel therapeutic agents.

The molecular structure of 1-Amino-3-methyl-1H-pyrrole-2-carboxamide consists of a pyrrole ring with an amino group and a methyl group attached to the carbon atoms. The presence of these functional groups imparts specific chemical and biological properties to the molecule, making it an attractive candidate for drug discovery and development.

Recent studies have highlighted the pharmacological activities of 1-Amino-3-methyl-1H-pyrrole-2-carboxamide. One notable area of research is its potential as an anti-inflammatory agent. In vitro and in vivo experiments have demonstrated that this compound can effectively inhibit the production of pro-inflammatory cytokines, such as TNF-α and IL-6, which are key mediators of inflammatory responses. This property makes it a promising candidate for the treatment of inflammatory diseases, including rheumatoid arthritis and inflammatory bowel disease.

Additionally, 1-Amino-3-methyl-1H-pyrrole-2-carboxamide has shown potential as an antitumor agent. Preclinical studies have indicated that it can induce apoptosis in cancer cells by modulating key signaling pathways involved in cell survival and proliferation. Specifically, it has been shown to inhibit the PI3K/Akt pathway, which is frequently dysregulated in various types of cancer. This mechanism of action suggests that 1-Amino-3-methyl-1H-pyrrole-2-carboxamide could be a valuable addition to the arsenal of anticancer drugs.

The pharmacokinetic properties of 1-Amino-3-methyl-1H-pyrrole-2-carboxamide have also been investigated. Studies have shown that it exhibits good oral bioavailability and favorable pharmacokinetic profiles, making it suitable for further development as an oral therapeutic agent. Its stability under physiological conditions and its ability to cross the blood-brain barrier have also been evaluated, indicating its potential for treating central nervous system disorders.

In terms of safety, preliminary toxicological studies have indicated that 1-Amino-3-methyl-1H-pyrrole-2-carboxamide has a low toxicity profile at therapeutic doses. However, further research is needed to fully understand its long-term safety and potential side effects. Clinical trials are currently underway to assess its efficacy and safety in human subjects.

The synthetic routes for producing 1-Amino-3-methyl-1H-pyrrole-2-carboxamide have been well-documented in the literature. Various methods have been developed to synthesize this compound efficiently and on a large scale, which is crucial for its commercialization as a pharmaceutical product. These synthetic strategies often involve multistep reactions that utilize readily available starting materials and reagents.

In conclusion, 1-Amino-3-methyl-1H-pyrrole-2-carboxamide (CAS No. 310436-79-4) is a promising compound with diverse biological activities and potential therapeutic applications. Its anti-inflammatory and antitumor properties make it a valuable candidate for further research and development in the pharmaceutical industry. Ongoing studies are expected to provide more insights into its mechanisms of action and clinical utility, paving the way for its use in treating various diseases.

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