chempirical

6-Ethyl-5-fluoro-4(3H)-pyrimidinone

C6H7FN2OCAS 137234-87-8142.13 g/mol

Open in Covalent MOL file
NNOHF
Aryl halidePhenol

Properties

Molecular formula
C6H7FN2O
Molar mass
142.13 g/mol
Exact mass
142.0542 Da
logP
0.88Crippen estimate
Polar surface area
46.0 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
1

Identifiers

CAS number
137234-87-8
SMILES
CCc1ncnc(O)c1F
InChIKey
ZEMRCKIJEFNNCO-UHFFFAOYSA-N
InChI
InChI=1S/C6H7FN2O/c1-2-4-5(7)6(10)9-3-8-4/h3H,2H2,1H3,(H,8,9,10)

Weigh it out

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

Names and synonyms

5 names
  • 4(3H)-Pyrimidinone, 6-ethyl-5-fluoro-
  • 4(1H)-Pyrimidinone, 6-ethyl-5-fluoro-
  • 6-Ethyl-5-fluoropyrimidin-4(3H)-one
  • 6-Ethyl-5-fluoro-4-hydroxypyrimidine
  • 6-Ethyl-5-fluoropyrimidin-4-ol

Work with 6-Ethyl-5-fluoro-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

5-Fluoro-6-hydroxy-4(3H)-pyrimidinone106615-61-659 % similar 4-Chloro-6-ethyl-5-fluoropyrimidine137234-74-358 % similar 4-Ethyl-5-fluoropyrimidine137234-88-943 % similar 4,5-Dichloro-6-ethylpyrimidine115617-41-939 % similar 2,3-Diethylpyrazine15707-24-137 % similar 5-Fluoro-4(3H)-pyrimidinone671-35-234 % similar 5-Ethyl-2,4(1H,3H)-pyrimidinedione4212-49-134 % similar 7-Fluoroquinazolin-4(3H)-one16499-57-333 % similar

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

Elsewhere

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