7-fluoro-2,3-dimethoxy-5-methylquinoxaline

C11H11FN2O2 — CID 23298052

IUPAC7-fluoro-2,3-dimethoxy-5-methylquinoxaline
SMILESCOc1nc2cc(F)cc(C)c2nc1OC
InChIInChI=1S/C11H11FN2O2/c1-6-4-7(12)5-8-9(6)14-11(16-3)10(13-8)15-2/h4-5H,1-3H3
InChIKeyKTLIKCGDJMYANC-UHFFFAOYSA-N
MW222.22 g/mol
LogP2.09
Rot. Bonds2

About 7-fluoro-2,3-dimethoxy-5-methylquinoxaline

7-fluoro-2,3-dimethoxy-5-methylquinoxaline (PubChem CID 23298052) has the molecular formula C11H11FN2O2 and a molecular weight of 222.22 g/mol. Its IUPAC name is 7-fluoro-2,3-dimethoxy-5-methylquinoxaline.

Molecular Properties

Compound Name7-fluoro-2,3-dimethoxy-5-methylquinoxaline
PubChem CID23298052
Molecular FormulaC11H11FN2O2
Molecular Weight222.22 g/mol
Exact Mass222.08
IUPAC Name7-fluoro-2,3-dimethoxy-5-methylquinoxaline
SMILESCOc1nc2cc(F)cc(C)c2nc1OC
InChIInChI=1S/C11H11FN2O2/c1-6-4-7(12)5-8-9(6)14-11(16-3)10(13-8)15-2/h4-5H,1-3H3
InChIKeyKTLIKCGDJMYANC-UHFFFAOYSA-N
XLogP2.09
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.22
LogP ≤ 52.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-fluoro-2,3-dimethoxy-5-methylquinoxaline?
The IUPAC name of 7-fluoro-2,3-dimethoxy-5-methylquinoxaline (CID 23298052) is 7-fluoro-2,3-dimethoxy-5-methylquinoxaline.
What is the SMILES notation for 7-fluoro-2,3-dimethoxy-5-methylquinoxaline?
The canonical SMILES for 7-fluoro-2,3-dimethoxy-5-methylquinoxaline is COc1nc2cc(F)cc(C)c2nc1OC.
What is the InChIKey of 7-fluoro-2,3-dimethoxy-5-methylquinoxaline?
The InChIKey is KTLIKCGDJMYANC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11FN2O2/c1-6-4-7(12)5-8-9(6)14-11(16-3)10(13-8)15-2/h4-5H,1-3H3.
What are the key properties of 7-fluoro-2,3-dimethoxy-5-methylquinoxaline?
7-fluoro-2,3-dimethoxy-5-methylquinoxaline has a molecular weight of 222.22 g/mol, XLogP of 2.09, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-2,3-dimethoxy-5-methylquinoxaline is sourced from PubChem (CID 23298052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).