NUQ

5-[5-(4-fluorophenyl)-1~{H}-imidazol-4-yl]-1-methyl-pyridin-2-one

Created:2019-12-16
Last modified:  2020-02-19

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Chemical Details

Formal Charge0
Atom Count32
Chiral Atom Count0
Bond Count34
Aromatic Bond Count11
2D diagram of NUQ

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Chemical Component Summary

Name5-[5-(4-fluorophenyl)-1~{H}-imidazol-4-yl]-1-methyl-pyridin-2-one
Systematic Name (OpenEye OEToolkits)5-[5-(4-fluorophenyl)-1~{H}-imidazol-4-yl]-1-methyl-pyridin-2-one
FormulaC15 H12 F N3 O
Molecular Weight269.274
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESCACTVS3.385CN1C=C(C=CC1=O)c2nc[nH]c2c3ccc(F)cc3
SMILESOpenEye OEToolkits2.0.7CN1C=C(C=CC1=O)c2c([nH]cn2)c3ccc(cc3)F
Canonical SMILESCACTVS3.385 CN1C=C(C=CC1=O)c2nc[nH]c2c3ccc(F)cc3
Canonical SMILESOpenEye OEToolkits2.0.7 CN1C=C(C=CC1=O)c2c([nH]cn2)c3ccc(cc3)F
InChIInChI1.03 InChI=1S/C15H12FN3O/c1-19-8-11(4-7-13(19)20)15-14(17-9-18-15)10-2-5-12(16)6-3-10/h2-9H,1H3,(H,17,18)
InChIKeyInChI1.03 QXLXUFQMLZRGPI-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 145946096