chempirical

2-Isopropyl-6-methyl-4-pyrimidinol

C8H12N2OCAS 2814-20-2152.20 g/mol

Open in Covalent MOL file
OHNN
Phenol

Properties

Molecular formula
C8H12N2O
Molar mass
152.20 g/mol
Exact mass
152.0950 Da
Melting point
170–172 °C
logP
1.61Crippen estimate
Polar surface area
46.0 Ų
H-bond donors / acceptors
1 / 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
2814-20-2
SMILES
Cc1cc(O)nc(C(C)C)n1
InChIKey
AJPIUNPJBFBUKK-UHFFFAOYSA-N
InChI
InChI=1S/C8H12N2O/c1-5(2)8-9-6(3)4-7(11)10-8/h4-5H,1-3H3,(H,9,10,11)

Weigh it out

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Names and synonyms

16 names · show all
  • 4(3H)-Pyrimidinone, 6-methyl-2-(1-methylethyl)-
  • 4(1H)-Pyrimidinone, 6-methyl-2-(1-methylethyl)-
  • 4(1H)-Pyrimidinone, 2-isopropyl-6-methyl-
  • 4-Pyrimidinol, 2-isopropyl-6-methyl-
  • 6-Methyl-2-(1-methylethyl)-4(3H)-pyrimidinone
  • IMHP
  • 2-Isopropyl-4-methyl-6-hydroxypyrimidine
  • 2-Isopropyl-4-methylpyrimidin-6-ol
  • 2-Isopropyl-6-methyl-4-hydroxypyrimidine
  • G 27550
  • 2-Isopropyl-6-methyl-4(3H)-pyrimidone
  • 2-Isopropyl-6-methyl-4-pyrimidone
  • Pyrimidinol
  • 4-Hydroxy-2-isopropyl-6-methylpyrimidine
  • 2-Isopropyl-4-methyl-6-pyrimidinone
  • 2-Isopropyl-4-hydroxy-6-methylpyrimidine

Work with 2-Isopropyl-6-methyl-4-pyrimidinol

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

6-Methyluracil626-48-253 % similar 2,6-Dimethyl-4(3H)-pyrimidinone6622-92-053 % similar Methylthiouracil56-04-250 % similar 4-Hydroxy-6-methyl-2(1H)-pyridinone3749-51-748 % similar 2-Hydroxy-4,6-dimethylpyrimidine hydrochloride34289-60-641 % similar 6-Methyl-4(3H)-pyrimidinone3524-87-641 % similar 2-Hydroxy-4,6-dimethylpyrimidine108-79-240 % similar Diazinon333-41-540 % similar

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

Same formula

2-(N-Methyl-N-(2-pyridyl)amino)ethanol122321-04-4 β-Oxo-1-piperidinepropanenitrile15029-30-8 Isopropyl methoxypyrazine25773-40-4 2-Ethoxy-3-ethylpyrazine35243-43-7 1-(Tetrahydro-2H-pyran-2-yl)-1H-pyrazole449758-17-2 2-Butyl-1H-imidazole-5-carboxaldehyde68282-49-5 4-(1,1-Dimethylethyl)-1H-imidazole-5-carboxaldehyde714273-83-3 3-(Aminomethyl)-4,6-dimethyl-1,2-dihydropyridin-2-one771579-27-2

Elsewhere

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