6-fluoro-4-(2-methoxyethyl)-1,3-dihydroquinoxalin-2-one

C11H13FN2O2 — CID 79296050

IUPAC6-fluoro-4-(2-methoxyethyl)-1,3-dihydroquinoxalin-2-one
SMILESCOCCN1CC(=O)Nc2ccc(F)cc21
InChIInChI=1S/C11H13FN2O2/c1-16-5-4-14-7-11(15)13-9-3-2-8(12)6-10(9)14/h2-3,6H,4-5,7H2,1H3,(H,13,15)
InChIKeyNPAPOXUIVSAHOJ-UHFFFAOYSA-N
MW224.23 g/mol
LogP1.23
Rot. Bonds3

About 6-fluoro-4-(2-methoxyethyl)-1,3-dihydroquinoxalin-2-one

6-fluoro-4-(2-methoxyethyl)-1,3-dihydroquinoxalin-2-one (PubChem CID 79296050) has the molecular formula C11H13FN2O2 and a molecular weight of 224.23 g/mol. Its IUPAC name is 6-fluoro-4-(2-methoxyethyl)-1,3-dihydroquinoxalin-2-one.

Molecular Properties

Compound Name6-fluoro-4-(2-methoxyethyl)-1,3-dihydroquinoxalin-2-one
PubChem CID79296050
Molecular FormulaC11H13FN2O2
Molecular Weight224.23 g/mol
Exact Mass224.10
IUPAC Name6-fluoro-4-(2-methoxyethyl)-1,3-dihydroquinoxalin-2-one
SMILESCOCCN1CC(=O)Nc2ccc(F)cc21
InChIInChI=1S/C11H13FN2O2/c1-16-5-4-14-7-11(15)13-9-3-2-8(12)6-10(9)14/h2-3,6H,4-5,7H2,1H3,(H,13,15)
InChIKeyNPAPOXUIVSAHOJ-UHFFFAOYSA-N
XLogP1.23
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.23
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-fluoro-4-(2-methoxyethyl)-1,3-dihydroquinoxalin-2-one?
The IUPAC name of 6-fluoro-4-(2-methoxyethyl)-1,3-dihydroquinoxalin-2-one (CID 79296050) is 6-fluoro-4-(2-methoxyethyl)-1,3-dihydroquinoxalin-2-one.
What is the SMILES notation for 6-fluoro-4-(2-methoxyethyl)-1,3-dihydroquinoxalin-2-one?
The canonical SMILES for 6-fluoro-4-(2-methoxyethyl)-1,3-dihydroquinoxalin-2-one is COCCN1CC(=O)Nc2ccc(F)cc21.
What is the InChIKey of 6-fluoro-4-(2-methoxyethyl)-1,3-dihydroquinoxalin-2-one?
The InChIKey is NPAPOXUIVSAHOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FN2O2/c1-16-5-4-14-7-11(15)13-9-3-2-8(12)6-10(9)14/h2-3,6H,4-5,7H2,1H3,(H,13,15).
What are the key properties of 6-fluoro-4-(2-methoxyethyl)-1,3-dihydroquinoxalin-2-one?
6-fluoro-4-(2-methoxyethyl)-1,3-dihydroquinoxalin-2-one has a molecular weight of 224.23 g/mol, XLogP of 1.23, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-4-(2-methoxyethyl)-1,3-dihydroquinoxalin-2-one is sourced from PubChem (CID 79296050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).