chempirical

1-Carbamoyl-3-methylpyrazole

C5H7N3OCAS 873-50-7125.13 g/mol

Open in Covalent MOL file
NNH2ON

Properties

Molecular formula
C5H7N3O
Molar mass
125.13 g/mol
Exact mass
125.0589 Da
Melting point
127–128 °C
logP
0.53Crippen estimate
Polar surface area
61.9 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
0

Identifiers

CAS number
873-50-7
SMILES
Cc1ccn(C(=N)O)n1
InChIKey
PNZZQMXKKNDHNS-UHFFFAOYSA-N
InChI
InChI=1S/C5H7N3O/c1-4-2-3-8(7-4)5(6)9/h2-3H,1H3,(H2,6,9)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

7 names
  • 1H-Pyrazole-1-carboxamide, 3-methyl-
  • Pyrazole-1-carboxamide, 3-methyl-
  • 3-Methyl-1H-pyrazole-1-carboxamide
  • 3-Methylpyrazole-1-carboxamide
  • NSC 51116
  • NSC 75630
  • 3-Methyl-pyrazole-1-carboxylic acid amide

Work with 1-Carbamoyl-3-methylpyrazole

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

3,5-Dimethyl-1H-pyrazole-1-carboxamide934-48-547 % similar 3-Methyl-1-phenyl-1H-pyrazole1128-54-736 % similar 6-Methylnicotinamide6960-22-133 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

2-Amino-5-pyrimidinemethanol120747-85-5 2-Amino-5-methoxypyrimidine13418-77-4 4-Methoxy-2-pyrimidinamine155-90-8 1-Amino-1H-pyrrole-2-carboxamide159326-69-9 2-O-Methylcytosine3289-47-2 2-Amino-4-hydroxy-6-methylpyrimidine3977-29-5 5-Methylcytosine554-01-8 6-Methoxy-4-pyrimidinamine696-45-7

Elsewhere

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