chempirical

2,6-Diamino-5-nitroso-4(3H)-pyrimidinone

C4H5N5O2CAS 2387-48-6155.12 g/mol

Open in Covalent MOL file
HNNOHNONH2HN
PhenolPrimary amine

Properties

Molecular formula
C4H5N5O2
Molar mass
155.12 g/mol
Exact mass
155.0443 Da
logP
-0.43Crippen estimate
Polar surface area
128.2 Ų
H-bond donors / acceptors
4 / 6
Rotatable bonds
1

Identifiers

CAS number
2387-48-6
SMILES
N=c1nc(O)c(N=O)c(N)[nH]1
InChIKey
HVMRLFSFHWCUCG-UHFFFAOYSA-N
InChI
InChI=1S/C4H5N5O2/c5-2-1(9-11)3(10)8-4(6)7-2/h(H5,5,6,7,8,10)

Weigh it out

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

Names and synonyms

13 names · show all
  • 4(3H)-Pyrimidinone, 2,6-diamino-5-nitroso-
  • 4(1H)-Pyrimidinone, 2,6-diamino-5-nitroso-
  • 4-Pyrimidinol, 2,6-diamino-5-nitroso-
  • 2,6-Diamino-5-nitroso-4-pyrimidinol
  • 2,6-Diamino-4-hydroxy-5-nitrosopyrimidine
  • 2,4-Diamino-5-nitroso-6-pyrimidinol
  • 2,4-Diamino-6-hydroxy-5-nitrosopyrimidine
  • 2,4-Diamino-5-nitroso-6-hydroxypyrimidine
  • NSC 677503
  • NSC 83516
  • NSC 9301
  • 2,6-Diamino-5-nitroso-1,4-dihydropyrimidin-4-one
  • 2,6-Diamino-5-nitroso-1H-pyrimidin-4-one

Work with 2,6-Diamino-5-nitroso-4(3H)-pyrimidinone

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-Hydroxy-2,5,6-triaminopyrimidine1004-75-757 % similar 2,5,6-Triaminopyrimidin-4-ol sulfuric acid salt35011-47-350 % similar 2,5,6-Triamino-4-hydroxypyrimidine sulfate39267-74-850 % similar 2,5-Diamino-4,6-dihydroxypyrimidine40769-69-545 % similar 5-Nitroso-2,4,6-pyrimidinetriamine1006-23-144 % similar 6-Amino-5-nitroso-2,4(1H,3H)-pyrimidinedione5442-24-044 % similar 2-Amino-5,6-dimethyl-4(3H)-pyrimidinone3977-23-942 % similar 2,5-Diamino-4,6-dihydroxypyrimidine hydrochloride56830-58-141 % similar

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

Same formula

4,6-Diamino-5-nitropyrimidine2164-84-3

Elsewhere

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