2,5-diethyl-3,6-diphenylpyrazine

C20H20N2 — CID 625546

IUPAC2,5-diethyl-3,6-diphenylpyrazine
SMILESCCc1nc(-c2ccccc2)c(CC)nc1-c1ccccc1
InChIInChI=1S/C20H20N2/c1-3-17-19(15-11-7-5-8-12-15)22-18(4-2)20(21-17)16-13-9-6-10-14-16/h5-14H,3-4H2,1-2H3
InChIKeyVRPJNNSRYIVFOT-UHFFFAOYSA-N
MW288.39 g/mol
LogP4.94
Rot. Bonds4

About 2,5-diethyl-3,6-diphenylpyrazine

2,5-diethyl-3,6-diphenylpyrazine (PubChem CID 625546) has the molecular formula C20H20N2 and a molecular weight of 288.39 g/mol. Its IUPAC name is 2,5-diethyl-3,6-diphenylpyrazine.

Molecular Properties

Compound Name2,5-diethyl-3,6-diphenylpyrazine
PubChem CID625546
Molecular FormulaC20H20N2
Molecular Weight288.39 g/mol
Exact Mass288.16
IUPAC Name2,5-diethyl-3,6-diphenylpyrazine
SMILESCCc1nc(-c2ccccc2)c(CC)nc1-c1ccccc1
InChIInChI=1S/C20H20N2/c1-3-17-19(15-11-7-5-8-12-15)22-18(4-2)20(21-17)16-13-9-6-10-14-16/h5-14H,3-4H2,1-2H3
InChIKeyVRPJNNSRYIVFOT-UHFFFAOYSA-N
XLogP4.94
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 54.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,5-diethyl-3,6-diphenylpyrazine?
The IUPAC name of 2,5-diethyl-3,6-diphenylpyrazine (CID 625546) is 2,5-diethyl-3,6-diphenylpyrazine.
What is the SMILES notation for 2,5-diethyl-3,6-diphenylpyrazine?
The canonical SMILES for 2,5-diethyl-3,6-diphenylpyrazine is CCc1nc(-c2ccccc2)c(CC)nc1-c1ccccc1.
What is the InChIKey of 2,5-diethyl-3,6-diphenylpyrazine?
The InChIKey is VRPJNNSRYIVFOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2/c1-3-17-19(15-11-7-5-8-12-15)22-18(4-2)20(21-17)16-13-9-6-10-14-16/h5-14H,3-4H2,1-2H3.
What are the key properties of 2,5-diethyl-3,6-diphenylpyrazine?
2,5-diethyl-3,6-diphenylpyrazine has a molecular weight of 288.39 g/mol, XLogP of 4.94, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-diethyl-3,6-diphenylpyrazine is sourced from PubChem (CID 625546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).