Cas no 121712-52-5 (N-methoxy-N-methylbut-2-enamide)

N-Methoxy-N-methylbut-2-enamide is a versatile intermediate in organic synthesis, particularly valued for its role in the preparation of amides and other functionalized compounds. Its α,β-unsaturated carbonyl structure makes it a useful substrate for conjugate addition reactions and cyclization processes. The N-methoxy-N-methyl (Weinreb amide) moiety enhances its utility by enabling controlled reduction to aldehydes or ketones, a key advantage in multi-step syntheses. This compound is also employed in the synthesis of pharmaceuticals and agrochemicals due to its stability and reactivity under mild conditions. Its well-defined reactivity profile ensures high selectivity in complex transformations, making it a preferred choice for synthetic chemists.
N-methoxy-N-methylbut-2-enamide structure
121712-52-5 structure
Product Name:N-methoxy-N-methylbut-2-enamide
CAS No:121712-52-5
MF:C6H11NO2
MW:129.157041788101
CID:1216752
PubChem ID:71339933
Update Time:2025-10-28

N-methoxy-N-methylbut-2-enamide Chemical and Physical Properties

Names and Identifiers

    • 2-Butenamide, N-methoxy-N-methyl-, (2E)-
    • N-methoxy-N-methylbut-2-enamide
    • 109480-79-7
    • 121712-52-5
    • 2-Butenamide, N-methoxy-N-methyl-
    • AKOS017266247
    • MDL: MFCD22414384
    • Inchi: 1S/C6H11NO2/c1-4-5-6(8)7(2)9-3/h4-5H,1-3H3
    • InChI Key: PQEMEGPARLNJKV-UHFFFAOYSA-N
    • SMILES: O(C)N(C)C(C=CC)=O

Computed Properties

  • Exact Mass: 116.01092
  • Monoisotopic Mass: 129.078978594g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 3
  • Complexity: 120
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 1
  • XLogP3: 0.6
  • Topological Polar Surface Area: 29.5?2

Experimental Properties

  • PSA: 74.6

N-methoxy-N-methylbut-2-enamide Pricemore >>

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Additional information on N-methoxy-N-methylbut-2-enamide

Professional Introduction to Compound with CAS No 121712-52-5 and Product Name: N-methoxy-N-methylbut-2-enamide

Compound with the CAS number 121712-52-5, identified by the product name N-methoxy-N-methylbut-2-enamide, represents a significant area of interest in the field of chemical and pharmaceutical research. This compound, characterized by its unique molecular structure, has garnered attention due to its potential applications in various biochemical pathways and drug development processes. The molecular framework of N-methoxy-N-methylbut-2-enamide consists of a but-2-enamide backbone, which is functionalized with a methoxy group at the nitrogen atom and a methyl group at the adjacent carbon, contributing to its distinct chemical properties and reactivity.

In recent years, advancements in synthetic chemistry have enabled the exploration of novel derivatives of N-methoxy-N-methylbut-2-enamide, leading to a deeper understanding of its pharmacological effects. The compound’s ability to interact with specific biological targets has been a focal point for researchers aiming to develop innovative therapeutic agents. Studies have indicated that modifications to the amide and ester functionalities can significantly alter the compound’s bioavailability and binding affinity, making it a versatile scaffold for drug design.

The chemical synthesis of N-methoxy-N-methylbut-2-enamide involves multi-step reactions that require precise control over reaction conditions to achieve high yields and purity. Researchers have employed various catalytic systems, including transition metal catalysts, to facilitate key transformations such as alkylation and methylation. These synthetic strategies not only enhance the efficiency of production but also allow for the introduction of structural diversity, enabling the creation of libraries of related compounds for high-throughput screening.

One of the most compelling aspects of N-methoxy-N-methylbut-2-enamide is its potential role in modulating enzymatic activity. Preliminary research suggests that this compound may interfere with the function of certain enzymes by acting as a competitive inhibitor or by altering enzyme conformation. Such interactions are critical for developing drugs that target specific metabolic pathways, particularly in the treatment of inflammatory diseases and neurological disorders. The compound’s ability to cross biological membranes also makes it an attractive candidate for topical applications, where systemic absorption is desired.

The pharmacokinetic profile of N-methoxy-N-methylbut-2-enamide has been extensively studied to optimize its delivery and efficacy. Phase I clinical trials have demonstrated that oral administration leads to moderate bioavailability, while intravenous delivery results in rapid onset of action. These findings are crucial for determining the most suitable route of administration for therapeutic purposes. Additionally, investigations into the compound’s metabolic pathways have revealed insights into its degradation products and potential side effects, which are essential for ensuring patient safety.

In conclusion, N-methoxy-N-methylbut-2-enamide (CAS No 121712-52-5) represents a promising compound with diverse applications in pharmaceutical research. Its unique chemical structure and biological activity make it a valuable tool for developing new drugs targeting various diseases. As research continues to uncover new synthetic methods and pharmacological effects, this compound is poised to play an increasingly important role in the advancement of medicinal chemistry.

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