chempirical

N-Hydroxyisonicotinamidine

C6H7N3OCAS 1594-57-6137.14 g/mol

Open in Covalent MOL file
H2NNHON
AmidineOxime

Properties

Molecular formula
C6H7N3O
Molar mass
137.14 g/mol
Exact mass
137.0589 Da
Melting point
178–179 °C
logP
0.18Crippen estimate
Polar surface area
71.5 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
1

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
1594-57-6
SMILES
NC(=NO)c1ccncc1
InChIKey
ZUUATXHRJFHSGO-UHFFFAOYSA-N
InChI
InChI=1S/C6H7N3O/c7-6(9-10)5-1-3-8-4-2-5/h1-4,10H,(H2,7,9)

Weigh it out

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

Names and synonyms

10 names
  • 4-Pyridinecarboximidamide, N-hydroxy-
  • Isonicotinamidoxime
  • N-Hydroxy-4-pyridinecarboximidamide
  • Pyridine-4-amidoxime
  • 4-Pyridinecarboxamide oxime
  • 4-Pyridinecarboxamidoxime
  • NSC 43969
  • Isonicotinamide oxime
  • N′-Hydroxypyridine-4-carboximidamide
  • N′-Hydroxyisonicotinimidamide

Work with N-Hydroxyisonicotinamidine

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

4-Methylbenzamidoxime19227-13-557 % similar 4-Fluorobenzamidoxime22179-78-857 % similar 4-Chlorobenzamidoxime5033-28-357 % similar 4-Bromo-N'-hydroxybenzenecarboximidamide69113-23-157 % similar N-Hydroxy-4-(trifluoromethyl)benzenecarboximidamide22179-86-853 % similar 4-(Trifluoromethoxy)benzamidoxime56935-71-847 % similar Isonicotinamide1453-82-345 % similar 3,5-Bis(trifluoromethyl)benzamidoxime72111-09-244 % similar

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

Same formula

2-Aminopyridine-3-carboxamide13438-65-8 2-Aminoisonicotinamide13538-42-6 5-Aminopyridine-2-carboxamide145255-19-2 Picolinohydrazide1452-63-7 3-Pyridinecarboxamide oxime1594-58-7 N-Hydroxypicolinimidamide1772-01-6 6-Aminonicotinamide329-89-5 3-Amino-pyridine-2-carboxylic acid amide50608-99-6

Elsewhere

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