Cas no 18085-47-7 (N-(2-Methylpyridin-4-yl)acetamide)

N-(2-Methylpyridin-4-yl)acetamide is a versatile organic compound featuring a pyridine core substituted with a methyl group at the 2-position and an acetamide moiety at the 4-position. This structure imparts unique physicochemical properties, making it valuable in pharmaceutical and agrochemical research. The acetamide group enhances hydrogen-bonding potential, improving solubility and interaction with biological targets, while the methylpyridine scaffold contributes to stability and metabolic resistance. It serves as a key intermediate in synthesizing bioactive molecules, particularly in developing kinase inhibitors and antimicrobial agents. Its well-defined reactivity profile allows for selective modifications, facilitating the design of derivatives with tailored properties. High purity grades are available, ensuring reproducibility in research applications.
N-(2-Methylpyridin-4-yl)acetamide structure
18085-47-7 structure
Product Name:N-(2-Methylpyridin-4-yl)acetamide
CAS No:18085-47-7
MF:C8H10N2O
MW:150.177801609039
CID:122756
PubChem ID:13040382
Update Time:2025-07-02

N-(2-Methylpyridin-4-yl)acetamide Chemical and Physical Properties

Names and Identifiers

    • N-(2-Methylpyridin-4-yl)acetamide
    • 2-Methyl-4-acetamidopyridine
    • Acetamide,N-(2-methyl-4-pyridinyl)-
    • 4-Acetamido-2-methyl-pyridin
    • 4-Acetamino-2-methyl-pyridin
    • 4-acetylamino-2-methylpyridine
    • AB53272
    • Acetamide, N-(2-methyl-4-pyridinyl)-
    • N-(2-Methyl-4-pyridinyl)acetamide
    • 18085-47-7
    • AKOS006243264
    • SCHEMBL7672757
    • A4007
    • J-519526
    • FT-0687920
    • DTXSID70516042
    • MDL: MFCD09835091
    • Inchi: 1S/C8H10N2O/c1-6-5-8(3-4-9-6)10-7(2)11/h3-5H,1-2H3,(H,9,10,11)
    • InChI Key: XSNZNZJXEGKLQG-UHFFFAOYSA-N
    • SMILES: O=C(C)NC1C=CN=C(C)C=1

Computed Properties

  • Exact Mass: 150.07900
  • Monoisotopic Mass: 150.079312947g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 1
  • Complexity: 147
  • 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
  • Surface Charge: 0
  • Tautomer Count: 7
  • XLogP3: 0.4
  • Topological Polar Surface Area: 42?2

Experimental Properties

  • PSA: 41.99000
  • LogP: 1.42140

N-(2-Methylpyridin-4-yl)acetamide Security Information

N-(2-Methylpyridin-4-yl)acetamide Customs Data

  • HS CODE:2933399090
  • Customs Data:

    China Customs Code:

    2933399090

    Overview:

    2933399090. Other compounds with non fused pyridine rings in structure. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date

    Summary:

    2933399090. other compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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N-(2-Methylpyridin-4-yl)acetamide Suppliers

Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
(CAS:18085-47-7)N-(2-Methylpyridin-4-yl)acetamide
Order Number:A4007
Stock Status:in Stock
Quantity:5g
Purity:99%
Pricing Information Last Updated:Monday, 2 September 2024 16:03
Price ($):341.0

Additional information on N-(2-Methylpyridin-4-yl)acetamide

Comprehensive Analysis of N-(2-Methylpyridin-4-yl)acetamide (CAS No. 18085-47-7): Properties, Applications, and Industry Insights

N-(2-Methylpyridin-4-yl)acetamide (CAS No. 18085-47-7), a specialized organic compound, has garnered significant attention in pharmaceutical and agrochemical research due to its unique structural features. This acetamide derivative combines a pyridine ring with an N-acetyl functional group, making it a versatile intermediate in synthetic chemistry. Recent studies highlight its potential as a building block for drug discovery, particularly in developing kinase inhibitors and antimicrobial agents.

The molecular structure of N-(2-Methylpyridin-4-yl)acetamide features a 2-methylpyridine moiety at the 4-position, which enhances its solubility in polar solvents compared to simpler pyridine derivatives. With a molecular weight of 150.18 g/mol and melting point range of 98-102°C, this compound exhibits stability under standard laboratory conditions. Researchers frequently inquire about its synthetic routes – the most common method involves the acetylation of 4-amino-2-methylpyridine using acetic anhydride under controlled conditions.

In pharmaceutical applications, CAS 18085-47-7 serves as a precursor for heterocyclic compounds with potential biological activity. A 2023 study published in the Journal of Medicinal Chemistry demonstrated its utility in creating selective enzyme modulators. The compound's electron-rich pyridine nitrogen allows for diverse chemical modifications, addressing the growing demand for structure-activity relationship studies in drug development pipelines.

The agrochemical sector has explored N-(2-Methylpyridin-4-yl)acetamide as a potential plant growth regulator intermediate. Its structural similarity to nicotinamide derivatives makes it particularly interesting for developing sustainable crop protection solutions. Industry reports indicate increasing patent filings involving this compound for biodegradable pesticide formulations, aligning with the global shift toward eco-friendly agriculture practices.

Analytical characterization of 18085-47-7 typically employs HPLC purification (reverse-phase C18 columns) and structural confirmation via NMR spectroscopy (characteristic peaks at δ 2.3 ppm for methyl protons and δ 8.3 ppm for pyridine protons). Quality control protocols emphasize chromatographic purity (>98%) due to its pharmaceutical applications. Recent advancements in continuous flow chemistry have improved the scalability of its production while reducing organic solvent waste.

From a commercial perspective, N-(2-Methylpyridin-4-yl)acetamide has seen steady demand growth (CAGR 4.7% from 2020-2023 according to industry analysts). Suppliers typically offer it in kilogram-scale quantities with customized packaging options. The compound's global market distribution shows concentration in pharmaceutical manufacturing hubs, with increasing interest from contract research organizations specializing in fragment-based drug discovery.

Environmental and safety profiles of CAS 18085-47-7 have been thoroughly documented. While not classified as hazardous under GHS criteria, standard laboratory precautions (gloves, eye protection) are recommended during handling. Its biodegradation pathway has been studied in OECD 301 tests, showing complete mineralization within 28 days under aerobic conditions – a crucial factor for green chemistry applications.

Emerging research directions include exploring metal-organic frameworks incorporating this acetamide derivative for catalytic applications, and its potential in photodynamic therapy precursors. The compound's structure-property relationships continue to be investigated through computational chemistry methods, particularly density functional theory (DFT) calculations predicting its reactivity patterns.

For researchers sourcing N-(2-Methylpyridin-4-yl)acetamide, key considerations include supplier certifications (ISO 9001 compliance), batch-to-batch consistency, and availability of analytical data sheets. The compound's stability under various storage conditions (recommended: 2-8°C in airtight containers) ensures reliable performance in multi-step syntheses. Current price trends reflect its position as a specialty chemical, with bulk purchasing options becoming more accessible.

Future outlook for 18085-47-7 remains positive as drug discovery programs increasingly target nitrogen-containing heterocycles. Its balanced lipophilicity profile (calculated logP ≈ 0.9) makes it particularly valuable for central nervous system drug candidates. Ongoing optimization of synthetic methodologies may further enhance its commercial viability in coming years.

Recommended suppliers
Amadis Chemical Company Limited
(CAS:18085-47-7)N-(2-Methylpyridin-4-yl)acetamide
A4007
Purity:99%
Quantity:5g
Price ($):341.0
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