4-Acetamidoantipyrine

Synonyms: 4-Acetamidoantipyrine, "4-Acetaminoantipyrine", "Acetamidoantipyrine", "Acetylaminoantipyrine", "4-Acetoaminoantipyrine", "4-Acetylaminophenazone", "4-Acetylaminoantipyrine", "N-Acetyl-4-aminoantipyrine", "Acetylated 4-aminoantipyrine", "N-Acetylaminoantipyrine", "Acetyl-4-aminoantipyrine", "N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)acetamide", "N-(1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)acetamide", "MFC"

Source: 4-Acetamidoantipyrine is a drug metabolite of metamizole.

Identifiers:

IUPAC Name: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)acetamide
CAS Number: 83-15-8
PubChem ID: 65743
InChiKey: OIAGWXKSCXPNNZ-UHFFFAOYSA-N
Canonical SMILES: CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C

Structural Properties:

Molecular Formula: C₁₃H₁₅N₃O₂
Molecular Weight: 245,280

Pharmacophore Features:

Number of bond donors: 1
Number of bond acceptors: 3
Number of atoms different from hydrogen: 18

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2D structure (.sdf)
3D structure (.sdf)
3D structure (.mol2)
3D structure (.pdb)
3D structure (.pdbqt)

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