Cas no 89179-62-4 (1-Methyl-1H-pyrazole-3-carboxamide)

1-Methyl-1H-pyrazole-3-carboxamide structure
89179-62-4 structure
Product Name:1-Methyl-1H-pyrazole-3-carboxamide
CAS No:89179-62-4
MF:C5H7N3O
MW:125.128580331802
MDL:MFCD00464006
CID:1023633
PubChem ID:13464586
Update Time:2024-10-26

1-Methyl-1H-pyrazole-3-carboxamide Chemical and Physical Properties

Names and Identifiers

    • 1-Methyl-1H-pyrazole-3-carboxamide
    • 1-methylpyrazole-3-carboxamide
    • 1-Methyl-1H-pyrazole-3-carboxamide (ACI)
    • Pyrazole-3-carboxamide, 1-methyl- (7CI)
    • Y10580
    • 89179-62-4
    • DTXSID50541493
    • MFCD00464006
    • AS-61695
    • SY081425
    • DBSMXZFYDNXILM-UHFFFAOYSA-N
    • EN300-232506
    • ALBB-028883
    • AKOS005169604
    • DTXCID50492279
    • DB-328967
    • STL414917
    • CS-W007031
    • SCHEMBL169063
    • 1H-Pyrazole-3-carboxamide, 1-methyl-
    • MDL: MFCD00464006
    • Inchi: 1S/C5H7N3O/c1-8-3-2-4(7-8)5(6)9/h2-3H,1H3,(H2,6,9)
    • InChI Key: DBSMXZFYDNXILM-UHFFFAOYSA-N
    • SMILES: O=C(C1C=CN(C)N=1)N

Computed Properties

  • Exact Mass: 125.058911855 g/mol
  • Monoisotopic Mass: 125.058911855 g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 1
  • Complexity: 125
  • 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
  • Molecular Weight: 125.13
  • XLogP3: -0.6
  • Topological Polar Surface Area: 60.9?2

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1-Methyl-1H-pyrazole-3-carboxamide Production Method

Production Method 1

Reaction Conditions
1.1 Reagents: Ammonium hydroxide Solvents: Water
Reference
NN'-linked biazoles. Part 4. Nucleophilic substitution in quaternary salts of NN'-linked biazoles and related systems
Castellanos, Maria Luisa; Llinas, Montserrat; Bruix, Marta; De Mendoza, Javier; Martin, M. Rosario, Journal of the Chemical Society, 1985, (6), 1209-15

1-Methyl-1H-pyrazole-3-carboxamide Raw materials

1-Methyl-1H-pyrazole-3-carboxamide Preparation Products

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