methyl 3-methylquinoxaline-2-carboxylate

C11H10N2O2 — CID 10867376

IUPACmethyl 3-methylquinoxaline-2-carboxylate
SMILESCOC(=O)c1nc2ccccc2nc1C
InChIInChI=1S/C11H10N2O2/c1-7-10(11(14)15-2)13-9-6-4-3-5-8(9)12-7/h3-6H,1-2H3
InChIKeyPIMMFAGMQVADTQ-UHFFFAOYSA-N
MW202.21 g/mol
LogP1.72
Rot. Bonds1

About methyl 3-methylquinoxaline-2-carboxylate

methyl 3-methylquinoxaline-2-carboxylate (PubChem CID 10867376) has the molecular formula C11H10N2O2 and a molecular weight of 202.21 g/mol. Its IUPAC name is methyl 3-methylquinoxaline-2-carboxylate.

Molecular Properties

Compound Namemethyl 3-methylquinoxaline-2-carboxylate
PubChem CID10867376
Molecular FormulaC11H10N2O2
Molecular Weight202.21 g/mol
Exact Mass202.07
IUPAC Namemethyl 3-methylquinoxaline-2-carboxylate
SMILESCOC(=O)c1nc2ccccc2nc1C
InChIInChI=1S/C11H10N2O2/c1-7-10(11(14)15-2)13-9-6-4-3-5-8(9)12-7/h3-6H,1-2H3
InChIKeyPIMMFAGMQVADTQ-UHFFFAOYSA-N
XLogP1.72
TPSA52.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.21
LogP ≤ 51.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of methyl 3-methylquinoxaline-2-carboxylate?
The IUPAC name of methyl 3-methylquinoxaline-2-carboxylate (CID 10867376) is methyl 3-methylquinoxaline-2-carboxylate.
What is the SMILES notation for methyl 3-methylquinoxaline-2-carboxylate?
The canonical SMILES for methyl 3-methylquinoxaline-2-carboxylate is COC(=O)c1nc2ccccc2nc1C.
What is the InChIKey of methyl 3-methylquinoxaline-2-carboxylate?
The InChIKey is PIMMFAGMQVADTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O2/c1-7-10(11(14)15-2)13-9-6-4-3-5-8(9)12-7/h3-6H,1-2H3.
What are the key properties of methyl 3-methylquinoxaline-2-carboxylate?
methyl 3-methylquinoxaline-2-carboxylate has a molecular weight of 202.21 g/mol, XLogP of 1.72, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 3-methylquinoxaline-2-carboxylate is sourced from PubChem (CID 10867376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).