N-(1,4,5,6-Tetrahydro-4,6-dioxo-2-pyrimidinyl)cyanamide

C₅H₄N₄O₂CAS 55067-10-2152.11 g/mol

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Properties

Molecular formula: C₅H₄N₄O₂
Molar mass: 152.11 g/mol
Exact mass: 152.0334 Da
logP: 0.14Crippen estimate
Polar surface area: 101.3 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 0

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

55067-10-2

SMILES

N#CN=C1N=C(O)CC(O)=N1

InChIKey

JCHNBNRIALLIDT-UHFFFAOYSA-N

InChI

InChI=1S/C5H4N4O2/c6-2-7-5-8-3(10)1-4(11)9-5/h1H2,(H2,7,8,9,10,11)

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Names and synonyms

4 names

Cyanamide, N-(1,4,5,6-tetrahydro-4,6-dioxo-2-pyrimidinyl)-
Cyanamide, (1,4,5,6-tetrahydro-4,6-dioxo-2-pyrimidinyl)-
2-Pyrimidinecarbamonitrile, 4,6-dihydroxy-
Cyanoiminobarbituric acid

Work with N-(1,4,5,6-Tetrahydro-4,6-dioxo-2-pyrimidinyl)cyanamide

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

Thiobarbituric acid504-17-644 % similar Barbituric acid67-52-739 % similar Malonic dihydrazide3815-86-932 % similar N-(Aminocarbonyl)-2-cyanoacetamide1448-98-231 % similar Cyanoacetic acid hydrazide140-87-430 % similar

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

Same formula

Oxipurinol2465-59-0 Xanthine69-89-6

Elsewhere

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