1-(2H-quinoxalin-1-yloxy)-2H-quinoxaline

C16H14N4O — CID 141186803

IUPAC1-(2H-quinoxalin-1-yloxy)-2H-quinoxaline
SMILESC1=Nc2ccccc2N(ON2CC=Nc3ccccc32)C1
InChIInChI=1S/C16H14N4O/c1-3-7-15-13(5-1)17-9-11-19(15)21-20-12-10-18-14-6-2-4-8-16(14)20/h1-10H,11-12H2
InChIKeyXMUBYLLWUOIERT-UHFFFAOYSA-N
MW278.32 g/mol
LogP3.28
Rot. Bonds2

About 1-(2H-quinoxalin-1-yloxy)-2H-quinoxaline

1-(2H-quinoxalin-1-yloxy)-2H-quinoxaline (PubChem CID 141186803) has the molecular formula C16H14N4O and a molecular weight of 278.32 g/mol. Its IUPAC name is 1-(2H-quinoxalin-1-yloxy)-2H-quinoxaline.

Molecular Properties

Compound Name1-(2H-quinoxalin-1-yloxy)-2H-quinoxaline
PubChem CID141186803
Molecular FormulaC16H14N4O
Molecular Weight278.32 g/mol
Exact Mass278.12
IUPAC Name1-(2H-quinoxalin-1-yloxy)-2H-quinoxaline
SMILESC1=Nc2ccccc2N(ON2CC=Nc3ccccc32)C1
InChIInChI=1S/C16H14N4O/c1-3-7-15-13(5-1)17-9-11-19(15)21-20-12-10-18-14-6-2-4-8-16(14)20/h1-10H,11-12H2
InChIKeyXMUBYLLWUOIERT-UHFFFAOYSA-N
XLogP3.28
TPSA40.43 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.32
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(2H-quinoxalin-1-yloxy)-2H-quinoxaline?
The IUPAC name of 1-(2H-quinoxalin-1-yloxy)-2H-quinoxaline (CID 141186803) is 1-(2H-quinoxalin-1-yloxy)-2H-quinoxaline.
What is the SMILES notation for 1-(2H-quinoxalin-1-yloxy)-2H-quinoxaline?
The canonical SMILES for 1-(2H-quinoxalin-1-yloxy)-2H-quinoxaline is C1=Nc2ccccc2N(ON2CC=Nc3ccccc32)C1.
What is the InChIKey of 1-(2H-quinoxalin-1-yloxy)-2H-quinoxaline?
The InChIKey is XMUBYLLWUOIERT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N4O/c1-3-7-15-13(5-1)17-9-11-19(15)21-20-12-10-18-14-6-2-4-8-16(14)20/h1-10H,11-12H2.
What are the key properties of 1-(2H-quinoxalin-1-yloxy)-2H-quinoxaline?
1-(2H-quinoxalin-1-yloxy)-2H-quinoxaline has a molecular weight of 278.32 g/mol, XLogP of 3.28, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2H-quinoxalin-1-yloxy)-2H-quinoxaline is sourced from PubChem (CID 141186803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).