Cas no 299916-90-8 (Acetamide,N-(1,6-dihydro-4-methyl-5-nitro-6-oxo-2-pyrimidinyl)-)

Acetamide,N-(1,6-dihydro-4-methyl-5-nitro-6-oxo-2-pyrimidinyl)- structure
299916-90-8 structure
Product Name:Acetamide,N-(1,6-dihydro-4-methyl-5-nitro-6-oxo-2-pyrimidinyl)-
CAS No:299916-90-8
MF:C7H8N4O4
MW:212.16282081604
MDL:MFCD31555304
CID:249362
PubChem ID:135677719
Update Time:2025-07-09

Acetamide,N-(1,6-dihydro-4-methyl-5-nitro-6-oxo-2-pyrimidinyl)- Chemical and Physical Properties

Names and Identifiers

    • Acetamide,N-(1,6-dihydro-4-methyl-5-nitro-6-oxo-2-pyrimidinyl)-
    • Acetamide,N-(1,4-dihydro-6-methyl-5-nitro-4-oxo-2-pyrimidinyl)- (9CI)
    • MFCD31555304
    • Acetamide, N-(1,4-dihydro-6-methyl-5-nitro-4-oxo-2-pyrimidinyl)-
    • AKOS037646969
    • AS-71757
    • 2-(acetylamino)-6-methyl-5-nitropyrimidin-4(3h)-one
    • N-(4-hydroxy-6-methyl-5-nitropyrimidin-2-yl)acetamide
    • 299916-90-8
    • ACETAMIDE,N-(1,4-DIHYDRO-6-METHYL-5-NITRO-4-OXO-PYRIMIDIN-2-YL)-
    • SCHEMBL4069622
    • W13533
    • N-(4-methyl-5-nitro-6-oxo-1H-pyrimidin-2-yl)acetamide
    • FTUUKELCLGAATN-UHFFFAOYSA-N
    • DB-122274
    • MDL: MFCD31555304
    • Inchi: 1S/C7H8N4O4/c1-3-5(11(14)15)6(13)10-7(8-3)9-4(2)12/h1-2H3,(H2,8,9,10,12,13)
    • InChI Key: FTUUKELCLGAATN-UHFFFAOYSA-N
    • SMILES: O=C1C(=C(C)N=C(NC(C)=O)N1)[N+](=O)[O-]

Computed Properties

  • Exact Mass: 212.055
  • Monoisotopic Mass: 212.055
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 1
  • Complexity: 404
  • 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
  • Topological Polar Surface Area: 116A^2
  • XLogP3: -0.7

Acetamide,N-(1,6-dihydro-4-methyl-5-nitro-6-oxo-2-pyrimidinyl)- Pricemore >>

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Acetamide,N-(1,6-dihydro-4-methyl-5-nitro-6-oxo-2-pyrimidinyl)- Related Literature

Additional information on Acetamide,N-(1,6-dihydro-4-methyl-5-nitro-6-oxo-2-pyrimidinyl)-

Comprehensive Overview of Acetamide, N-(1,6-dihydro-4-methyl-5-nitro-6-oxo-2-pyrimidinyl)- (CAS No. 299916-90-8)

Acetamide, N-(1,6-dihydro-4-methyl-5-nitro-6-oxo-2-pyrimidinyl)- (CAS No. 299916-90-8) is a specialized organic compound that has garnered significant attention in pharmaceutical and agrochemical research. This compound, often referred to by its systematic name, belongs to the class of pyrimidine derivatives, which are known for their diverse biological activities. The presence of a nitro group and a methyl substituent in its structure makes it a valuable intermediate in the synthesis of more complex molecules. Researchers are particularly interested in its potential applications in drug discovery and crop protection, given the rising demand for novel therapeutic agents and sustainable agricultural solutions.

The molecular structure of Acetamide, N-(1,6-dihydro-4-methyl-5-nitro-6-oxo-2-pyrimidinyl)- features a pyrimidine ring with a nitro group at the 5-position and a methyl group at the 4-position. This configuration is critical for its reactivity and interaction with biological targets. Recent studies have explored its role as a building block in the synthesis of heterocyclic compounds, which are pivotal in developing new antimicrobial and anti-inflammatory agents. The compound's unique properties align with the growing trend of green chemistry, as researchers seek eco-friendly synthetic routes to minimize environmental impact.

In the context of pharmaceutical applications, Acetamide, N-(1,6-dihydro-4-methyl-5-nitro-6-oxo-2-pyrimidinyl)- has been investigated for its potential to modulate enzyme activity. For instance, its pyrimidine core is structurally similar to nucleotides, making it a candidate for enzyme inhibition studies. This is particularly relevant in the era of personalized medicine, where targeted therapies are gaining traction. Additionally, the compound's nitro group offers opportunities for further chemical modifications, enabling the creation of libraries of derivatives for high-throughput screening.

The agrochemical industry has also shown interest in Acetamide, N-(1,6-dihydro-4-methyl-5-nitro-6-oxo-2-pyrimidinyl)- due to its potential as a pesticide intermediate. With the global push toward sustainable agriculture, there is a need for compounds that can enhance crop yields while minimizing ecological harm. The nitro and methyl functional groups in this compound may contribute to its herbicidal or fungicidal properties, though further research is needed to confirm its efficacy and safety. This aligns with the increasing consumer demand for organic farming and reduced chemical residues in food products.

From a synthetic chemistry perspective, Acetamide, N-(1,6-dihydro-4-methyl-5-nitro-6-oxo-2-pyrimidinyl)- presents both challenges and opportunities. Its nitro group can undergo reduction to form amino derivatives, which are valuable in constructing more complex molecules. However, handling nitro compounds requires careful consideration of reaction conditions to avoid unwanted side reactions. Advances in catalysis and flow chemistry have opened new avenues for optimizing the synthesis of such compounds, reducing waste and improving yields.

The compound's relevance extends to material science, where its heterocyclic framework could be incorporated into polymers or coatings with specific properties. For example, pyrimidine-based compounds are known for their thermal stability and electronic properties, making them candidates for advanced materials in electronics or energy storage. This interdisciplinary potential highlights the versatility of Acetamide, N-(1,6-dihydro-4-methyl-5-nitro-6-oxo-2-pyrimidinyl)- and its alignment with cutting-edge research trends.

In summary, Acetamide, N-(1,6-dihydro-4-methyl-5-nitro-6-oxo-2-pyrimidinyl)- (CAS No. 299916-90-8) is a multifaceted compound with promising applications in pharmaceuticals, agrochemicals, and material science. Its structural features, including the pyrimidine ring, nitro group, and methyl substituent, make it a valuable tool for researchers exploring new therapeutic agents, sustainable crop protection solutions, and innovative materials. As the scientific community continues to prioritize green chemistry and interdisciplinary research, this compound is likely to remain a focus of ongoing investigations.

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