ethyl 6-methoxyquinoxaline-2-carboxylate

C12H12N2O3 — CID 22917221

IUPACethyl 6-methoxyquinoxaline-2-carboxylate
SMILESCCOC(=O)c1cnc2cc(OC)ccc2n1
InChIInChI=1S/C12H12N2O3/c1-3-17-12(15)11-7-13-10-6-8(16-2)4-5-9(10)14-11/h4-7H,3H2,1-2H3
InChIKeyDSOZMILVCBHYJW-UHFFFAOYSA-N
MW232.24 g/mol
LogP1.82
Rot. Bonds3

About ethyl 6-methoxyquinoxaline-2-carboxylate

ethyl 6-methoxyquinoxaline-2-carboxylate (PubChem CID 22917221) has the molecular formula C12H12N2O3 and a molecular weight of 232.24 g/mol. Its IUPAC name is ethyl 6-methoxyquinoxaline-2-carboxylate.

Molecular Properties

Compound Nameethyl 6-methoxyquinoxaline-2-carboxylate
PubChem CID22917221
Molecular FormulaC12H12N2O3
Molecular Weight232.24 g/mol
Exact Mass232.08
IUPAC Nameethyl 6-methoxyquinoxaline-2-carboxylate
SMILESCCOC(=O)c1cnc2cc(OC)ccc2n1
InChIInChI=1S/C12H12N2O3/c1-3-17-12(15)11-7-13-10-6-8(16-2)4-5-9(10)14-11/h4-7H,3H2,1-2H3
InChIKeyDSOZMILVCBHYJW-UHFFFAOYSA-N
XLogP1.82
TPSA61.31 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.24
LogP ≤ 51.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl quinoxaline-2-carboxylate
CID 582701
ethyl 7-methoxyquinoline-3-carboxylate;hydrochloride
CID 22326874
ethyl quinoxaline-2-carboxylate;1H-pyrrole
CID 175129436
ethyl 2-(7-methoxyquinolin-3-yl)acetate
CID 90417413
ethyl 7-methoxyquinoline-3-carboxylate;methyl 7-hydroxyquinoline-3-carboxylate
CID 158875379
ethyl 6-methoxy-4-(methylamino)quinoline-3-carboxylate
CID 46397911
[2-(2,4-dimethoxyanilino)-2-oxoethyl] quinoxaline-2-carboxylate
CID 17417789
ethyl 6-methoxy-4-naphthalen-2-ylquinoline-2-carboxylate
CID 132534382
4-bromo-6-methoxyquinoline-3-carboxylic acid;ethyl 4-bromo-6-methoxyquinoline-3-carboxylate
CID 68806216
ethyl (2S)-2-amino-3-(6-methoxyquinolin-3-yl)propanoate
CID 18637046
2-O-ethyl 3-O-methyl 7-methoxyquinoline-2,3-dicarboxylate
CID 134910532
diethyl 6-methoxyazulene-1,3-dicarboxylate
CID 101063451

Frequently Asked Questions

What is the IUPAC name of ethyl 6-methoxyquinoxaline-2-carboxylate?
The IUPAC name of ethyl 6-methoxyquinoxaline-2-carboxylate (CID 22917221) is ethyl 6-methoxyquinoxaline-2-carboxylate.
What is the SMILES notation for ethyl 6-methoxyquinoxaline-2-carboxylate?
The canonical SMILES for ethyl 6-methoxyquinoxaline-2-carboxylate is CCOC(=O)c1cnc2cc(OC)ccc2n1.
What is the InChIKey of ethyl 6-methoxyquinoxaline-2-carboxylate?
The InChIKey is DSOZMILVCBHYJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O3/c1-3-17-12(15)11-7-13-10-6-8(16-2)4-5-9(10)14-11/h4-7H,3H2,1-2H3.
What are the key properties of ethyl 6-methoxyquinoxaline-2-carboxylate?
ethyl 6-methoxyquinoxaline-2-carboxylate has a molecular weight of 232.24 g/mol, XLogP of 1.82, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 6-methoxyquinoxaline-2-carboxylate is sourced from PubChem (CID 22917221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).