4-ethyl-6-fluoro-2-methyl-2,3-dihydro-1H-quinoxaline

C11H15FN2 — CID 115095182

IUPAC4-ethyl-6-fluoro-2-methyl-2,3-dihydro-1H-quinoxaline
SMILESCCN1CC(C)Nc2ccc(F)cc21
InChIInChI=1S/C11H15FN2/c1-3-14-7-8(2)13-10-5-4-9(12)6-11(10)14/h4-6,8,13H,3,7H2,1-2H3
InChIKeyHUVLWCPCHWMSDQ-UHFFFAOYSA-N
MW194.25 g/mol
LogP2.47
Rot. Bonds1

About 4-ethyl-6-fluoro-2-methyl-2,3-dihydro-1H-quinoxaline

4-ethyl-6-fluoro-2-methyl-2,3-dihydro-1H-quinoxaline (PubChem CID 115095182) has the molecular formula C11H15FN2 and a molecular weight of 194.25 g/mol. Its IUPAC name is 4-ethyl-6-fluoro-2-methyl-2,3-dihydro-1H-quinoxaline.

Molecular Properties

Compound Name4-ethyl-6-fluoro-2-methyl-2,3-dihydro-1H-quinoxaline
PubChem CID115095182
Molecular FormulaC11H15FN2
Molecular Weight194.25 g/mol
Exact Mass194.12
IUPAC Name4-ethyl-6-fluoro-2-methyl-2,3-dihydro-1H-quinoxaline
SMILESCCN1CC(C)Nc2ccc(F)cc21
InChIInChI=1S/C11H15FN2/c1-3-14-7-8(2)13-10-5-4-9(12)6-11(10)14/h4-6,8,13H,3,7H2,1-2H3
InChIKeyHUVLWCPCHWMSDQ-UHFFFAOYSA-N
XLogP2.47
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.25
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-6-fluoro-2-methyl-2,3-dihydro-1H-quinoxaline?
The IUPAC name of 4-ethyl-6-fluoro-2-methyl-2,3-dihydro-1H-quinoxaline (CID 115095182) is 4-ethyl-6-fluoro-2-methyl-2,3-dihydro-1H-quinoxaline.
What is the SMILES notation for 4-ethyl-6-fluoro-2-methyl-2,3-dihydro-1H-quinoxaline?
The canonical SMILES for 4-ethyl-6-fluoro-2-methyl-2,3-dihydro-1H-quinoxaline is CCN1CC(C)Nc2ccc(F)cc21.
What is the InChIKey of 4-ethyl-6-fluoro-2-methyl-2,3-dihydro-1H-quinoxaline?
The InChIKey is HUVLWCPCHWMSDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15FN2/c1-3-14-7-8(2)13-10-5-4-9(12)6-11(10)14/h4-6,8,13H,3,7H2,1-2H3.
What are the key properties of 4-ethyl-6-fluoro-2-methyl-2,3-dihydro-1H-quinoxaline?
4-ethyl-6-fluoro-2-methyl-2,3-dihydro-1H-quinoxaline has a molecular weight of 194.25 g/mol, XLogP of 2.47, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-6-fluoro-2-methyl-2,3-dihydro-1H-quinoxaline is sourced from PubChem (CID 115095182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).