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The synthesis, structure and properties of N-acetylated derivatives of ethyl 3-amino-1H-pyrazole-4-carboxylate.

2007

Ethyl 3-amino-1H-pyrazole-4-carboxylate (1) was yielded through total synthesis and reacted with acetic anhydride to give the acetylated products 2-6. Compounds 1-6 were studied with HPLC, X-ray, FT-IR, (1)H-NMR, (13)C-NMR and MS. Acetylation was carried out in solvents of various polarity, namely; chloroform; dioxane; DMF; acetic anhydride, at room temperature and at boiling points; and in the presence and absence of DMAP. The acetylated products are mainly nitrogen atoms in the ring. The position of the ring proton in the solution was based on NOESY; multinuclear HMBC, HSQC spectra and calculations. For equivalent amounts (1-1.5 mol) of acetic anhydride at room temperature two products of…

Models MolecularMagnetic Resonance Spectroscopy13C-NMR spectraAcetic AnhydridesRing (chemistry)Crystallography X-RayCatalysisCatalysischemistry.chemical_compoundDrug DiscoverySpectroscopy Fourier Transform InfraredOrganic chemistry4-AminopyridineFT-IR spectraChromatography High Pressure Liquidhetareneamino acidChloroformTemperatureTotal synthesisAcetylationGeneral ChemistryGeneral MedicineNuclear magnetic resonance spectroscopyhydrogen bondingSolventAcetic anhydridechemistry1H-NMR spectraDimethylformamidePyrazolesIndicators and ReagentsChromatography Thin LayerChemicalpharmaceutical bulletin
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