2,6-diphenoxypyrazine

C16H12N2O2 — CID 68982482

IUPAC2,6-diphenoxypyrazine
SMILESc1ccc(Oc2cncc(Oc3ccccc3)n2)cc1
InChIInChI=1S/C16H12N2O2/c1-3-7-13(8-4-1)19-15-11-17-12-16(18-15)20-14-9-5-2-6-10-14/h1-12H
InChIKeySFNVTIQWKSEZAH-UHFFFAOYSA-N
MW264.28 g/mol
LogP4.06
Rot. Bonds4

About 2,6-diphenoxypyrazine

2,6-diphenoxypyrazine (PubChem CID 68982482) has the molecular formula C16H12N2O2 and a molecular weight of 264.28 g/mol. Its IUPAC name is 2,6-diphenoxypyrazine.

Molecular Properties

Compound Name2,6-diphenoxypyrazine
PubChem CID68982482
Molecular FormulaC16H12N2O2
Molecular Weight264.28 g/mol
Exact Mass264.09
IUPAC Name2,6-diphenoxypyrazine
SMILESc1ccc(Oc2cncc(Oc3ccccc3)n2)cc1
InChIInChI=1S/C16H12N2O2/c1-3-7-13(8-4-1)19-15-11-17-12-16(18-15)20-14-9-5-2-6-10-14/h1-12H
InChIKeySFNVTIQWKSEZAH-UHFFFAOYSA-N
XLogP4.06
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.28
LogP ≤ 54.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,6-diphenoxypyrazine?
The IUPAC name of 2,6-diphenoxypyrazine (CID 68982482) is 2,6-diphenoxypyrazine.
What is the SMILES notation for 2,6-diphenoxypyrazine?
The canonical SMILES for 2,6-diphenoxypyrazine is c1ccc(Oc2cncc(Oc3ccccc3)n2)cc1.
What is the InChIKey of 2,6-diphenoxypyrazine?
The InChIKey is SFNVTIQWKSEZAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N2O2/c1-3-7-13(8-4-1)19-15-11-17-12-16(18-15)20-14-9-5-2-6-10-14/h1-12H.
What are the key properties of 2,6-diphenoxypyrazine?
2,6-diphenoxypyrazine has a molecular weight of 264.28 g/mol, XLogP of 4.06, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-diphenoxypyrazine is sourced from PubChem (CID 68982482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).