6,9-dimethoxy-2,3-dihydro-[1,4]dioxino[2,3-b]quinoxaline

C12H12N2O4 — CID 10658167

IUPAC6,9-dimethoxy-2,3-dihydro-[1,4]dioxino[2,3-b]quinoxaline
SMILESCOc1ccc(OC)c2nc3c(nc12)OCCO3
InChIInChI=1S/C12H12N2O4/c1-15-7-3-4-8(16-2)10-9(7)13-11-12(14-10)18-6-5-17-11/h3-4H,5-6H2,1-2H3
InChIKeySGFAQMCXKYGCDD-UHFFFAOYSA-N
MW248.24 g/mol
LogP1.42
Rot. Bonds2

About 6,9-dimethoxy-2,3-dihydro-[1,4]dioxino[2,3-b]quinoxaline

6,9-dimethoxy-2,3-dihydro-[1,4]dioxino[2,3-b]quinoxaline (PubChem CID 10658167) has the molecular formula C12H12N2O4 and a molecular weight of 248.24 g/mol. Its IUPAC name is 6,9-dimethoxy-2,3-dihydro-[1,4]dioxino[2,3-b]quinoxaline.

Molecular Properties

Compound Name6,9-dimethoxy-2,3-dihydro-[1,4]dioxino[2,3-b]quinoxaline
PubChem CID10658167
Molecular FormulaC12H12N2O4
Molecular Weight248.24 g/mol
Exact Mass248.08
IUPAC Name6,9-dimethoxy-2,3-dihydro-[1,4]dioxino[2,3-b]quinoxaline
SMILESCOc1ccc(OC)c2nc3c(nc12)OCCO3
InChIInChI=1S/C12H12N2O4/c1-15-7-3-4-8(16-2)10-9(7)13-11-12(14-10)18-6-5-17-11/h3-4H,5-6H2,1-2H3
InChIKeySGFAQMCXKYGCDD-UHFFFAOYSA-N
XLogP1.42
TPSA62.70 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.24
LogP ≤ 51.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6,9-dimethoxy-2,3-dihydro-[1,4]dioxino[2,3-b]quinoxaline?
The IUPAC name of 6,9-dimethoxy-2,3-dihydro-[1,4]dioxino[2,3-b]quinoxaline (CID 10658167) is 6,9-dimethoxy-2,3-dihydro-[1,4]dioxino[2,3-b]quinoxaline.
What is the SMILES notation for 6,9-dimethoxy-2,3-dihydro-[1,4]dioxino[2,3-b]quinoxaline?
The canonical SMILES for 6,9-dimethoxy-2,3-dihydro-[1,4]dioxino[2,3-b]quinoxaline is COc1ccc(OC)c2nc3c(nc12)OCCO3.
What is the InChIKey of 6,9-dimethoxy-2,3-dihydro-[1,4]dioxino[2,3-b]quinoxaline?
The InChIKey is SGFAQMCXKYGCDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O4/c1-15-7-3-4-8(16-2)10-9(7)13-11-12(14-10)18-6-5-17-11/h3-4H,5-6H2,1-2H3.
What are the key properties of 6,9-dimethoxy-2,3-dihydro-[1,4]dioxino[2,3-b]quinoxaline?
6,9-dimethoxy-2,3-dihydro-[1,4]dioxino[2,3-b]quinoxaline has a molecular weight of 248.24 g/mol, XLogP of 1.42, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6,9-dimethoxy-2,3-dihydro-[1,4]dioxino[2,3-b]quinoxaline is sourced from PubChem (CID 10658167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).