5-Methylpyrimidin-4-ol

C₅H₆N₂OCAS 17758-52-0110.12 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₅H₆N₂O
Molar mass: 110.12 g/mol
Exact mass: 110.0480 Da
logP: 0.08Crippen estimate
Polar surface area: 45.8 Å²
H-bond donors / acceptors: 1 / 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

17758-52-0

SMILES

CC1=CN=CNC1=O

InChIKey

SHLJOANTPJWIHS-UHFFFAOYSA-N

InChI

InChI=1S/C5H6N2O/c1-4-2-6-3-7-5(4)8/h2-3H,1H3,(H,6,7,8)

Weigh it out

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

Names and synonyms

1 names

4-Pyrimidinol, 5-methyl-

Work with 5-Methylpyrimidin-4-ol

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-Methylimidazole822-36-644 % similar 2-Hydroxy-3-methylpyridine91914-04-443 % similar 4-Iodo-1H-imidazole71759-89-239 % similar 4,6-Dihydroxy-5-methylpyrimidine63447-38-138 % similar 4-Methylpyridazin-3-ol33471-40-838 % similar 3,4,5-Trimethylpyridine20579-43-537 % similar 1-(1H-Imidazol-4-yl)ethan-1-one61985-25-936 % similar Imidazole-4-carboxaldehyde3034-50-235 % similar

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

Same formula

3-Methyl-1H-pyrazole-4-carbaldehyde112758-40-4 6-Methyl-3(2H)-pyridazinone13327-27-0 1-Methyl-2-imidazolecarboxaldehyde13750-81-7 3-Hydroxypentanedinitrile13880-89-2 2-Aminopyridine N-oxide14150-95-9 4-Methylpyrimidin-2-ol hydrochloride15231-48-8 2-Amino-3-hydroxypyridine16867-03-1 1-Methyl-1H-imidazole-4-carbaldehyde17289-26-8

Elsewhere

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