6-fluoro-3-morpholin-4-yl-1H-quinoxalin-2-one

C12H12FN3O2 — CID 146168907

IUPAC6-fluoro-3-morpholin-4-yl-1H-quinoxalin-2-one
SMILESO=c1[nH]c2ccc(F)cc2nc1N1CCOCC1
InChIInChI=1S/C12H12FN3O2/c13-8-1-2-9-10(7-8)14-11(12(17)15-9)16-3-5-18-6-4-16/h1-2,7H,3-6H2,(H,15,17)
InChIKeyZJYLHYIEOIVKML-UHFFFAOYSA-N
MW249.24 g/mol
LogP0.90
Rot. Bonds1

About 6-fluoro-3-morpholin-4-yl-1H-quinoxalin-2-one

6-fluoro-3-morpholin-4-yl-1H-quinoxalin-2-one (PubChem CID 146168907) has the molecular formula C12H12FN3O2 and a molecular weight of 249.24 g/mol. Its IUPAC name is 6-fluoro-3-morpholin-4-yl-1H-quinoxalin-2-one.

Molecular Properties

Compound Name6-fluoro-3-morpholin-4-yl-1H-quinoxalin-2-one
PubChem CID146168907
Molecular FormulaC12H12FN3O2
Molecular Weight249.24 g/mol
Exact Mass249.09
IUPAC Name6-fluoro-3-morpholin-4-yl-1H-quinoxalin-2-one
SMILESO=c1[nH]c2ccc(F)cc2nc1N1CCOCC1
InChIInChI=1S/C12H12FN3O2/c13-8-1-2-9-10(7-8)14-11(12(17)15-9)16-3-5-18-6-4-16/h1-2,7H,3-6H2,(H,15,17)
InChIKeyZJYLHYIEOIVKML-UHFFFAOYSA-N
XLogP0.90
TPSA58.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.24
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-Morpholineacetamide, N-phenyl-
CID 201328
3-(Diethylamino)-1,2-dihydroquinoxalin-2-one
CID 2410719
N-(4-fluorophenyl)-2-morpholinoacetamide
CID 670650
3-[(3-Methoxypropyl)amino]-1,2-dihydroquinoxalin-2-one
CID 2408944
3-[Cyclohexyl(methyl)amino]-1,2-dihydroquinoxalin-2-one
CID 2409060
3-(4-methylpiperazin-1-yl)quinoxalin-2(1H)-one
CID 12686479
N-[2-(morpholin-4-yl)phenyl]acetamide
CID 826558
3-(2-morpholin-4-ylethylamino)-1H-quinoxalin-2-one
CID 665072
2-[methyl-[2-(2-morpholin-4-ylanilino)-2-oxoethyl]amino]-N-(2,3,4-trifluorophenyl)acetamide
CID 4876283
3-Morpholin-4-yl-quinoxalin-2-ol
CID 2388925
Ethyl 2-[[4-(1-cyclooctylpiperidin-4-yl)-3-oxoquinoxalin-2-yl]amino]acetate
CID 59451166
N-(2-fluorophenyl)-2-morpholinoacetamide
CID 675431

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-3-morpholin-4-yl-1H-quinoxalin-2-one?
The IUPAC name of 6-fluoro-3-morpholin-4-yl-1H-quinoxalin-2-one (CID 146168907) is 6-fluoro-3-morpholin-4-yl-1H-quinoxalin-2-one.
What is the SMILES notation for 6-fluoro-3-morpholin-4-yl-1H-quinoxalin-2-one?
The canonical SMILES for 6-fluoro-3-morpholin-4-yl-1H-quinoxalin-2-one is O=c1[nH]c2ccc(F)cc2nc1N1CCOCC1.
What is the InChIKey of 6-fluoro-3-morpholin-4-yl-1H-quinoxalin-2-one?
The InChIKey is ZJYLHYIEOIVKML-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12FN3O2/c13-8-1-2-9-10(7-8)14-11(12(17)15-9)16-3-5-18-6-4-16/h1-2,7H,3-6H2,(H,15,17).
What are the key properties of 6-fluoro-3-morpholin-4-yl-1H-quinoxalin-2-one?
6-fluoro-3-morpholin-4-yl-1H-quinoxalin-2-one has a molecular weight of 249.24 g/mol, XLogP of 0.90, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-3-morpholin-4-yl-1H-quinoxalin-2-one is sourced from PubChem (CID 146168907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).