2-[(E)-2-(4-methoxyphenyl)ethenyl]pyrazine

C13H12N2O — CID 15208513

IUPAC2-[(E)-2-(4-methoxyphenyl)ethenyl]pyrazine
SMILESCOc1ccc(/C=C/c2cnccn2)cc1
InChIInChI=1S/C13H12N2O/c1-16-13-6-3-11(4-7-13)2-5-12-10-14-8-9-15-12/h2-10H,1H3/b5-2+
InChIKeyFLBLCFXFHJGQGE-GORDUTHDSA-N
MW212.25 g/mol
LogP2.66
Rot. Bonds3

About 2-[(E)-2-(4-methoxyphenyl)ethenyl]pyrazine

2-[(E)-2-(4-methoxyphenyl)ethenyl]pyrazine (PubChem CID 15208513) has the molecular formula C13H12N2O and a molecular weight of 212.25 g/mol. Its IUPAC name is 2-[(E)-2-(4-methoxyphenyl)ethenyl]pyrazine.

Molecular Properties

Compound Name2-[(E)-2-(4-methoxyphenyl)ethenyl]pyrazine
PubChem CID15208513
Molecular FormulaC13H12N2O
Molecular Weight212.25 g/mol
Exact Mass212.09
IUPAC Name2-[(E)-2-(4-methoxyphenyl)ethenyl]pyrazine
SMILESCOc1ccc(/C=C/c2cnccn2)cc1
InChIInChI=1S/C13H12N2O/c1-16-13-6-3-11(4-7-13)2-5-12-10-14-8-9-15-12/h2-10H,1H3/b5-2+
InChIKeyFLBLCFXFHJGQGE-GORDUTHDSA-N
XLogP2.66
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(E)-2-(4-methoxyphenyl)ethenyl]pyrazine?
The IUPAC name of 2-[(E)-2-(4-methoxyphenyl)ethenyl]pyrazine (CID 15208513) is 2-[(E)-2-(4-methoxyphenyl)ethenyl]pyrazine.
What is the SMILES notation for 2-[(E)-2-(4-methoxyphenyl)ethenyl]pyrazine?
The canonical SMILES for 2-[(E)-2-(4-methoxyphenyl)ethenyl]pyrazine is COc1ccc(/C=C/c2cnccn2)cc1.
What is the InChIKey of 2-[(E)-2-(4-methoxyphenyl)ethenyl]pyrazine?
The InChIKey is FLBLCFXFHJGQGE-GORDUTHDSA-N. The full InChI is InChI=1S/C13H12N2O/c1-16-13-6-3-11(4-7-13)2-5-12-10-14-8-9-15-12/h2-10H,1H3/b5-2+.
What are the key properties of 2-[(E)-2-(4-methoxyphenyl)ethenyl]pyrazine?
2-[(E)-2-(4-methoxyphenyl)ethenyl]pyrazine has a molecular weight of 212.25 g/mol, XLogP of 2.66, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(E)-2-(4-methoxyphenyl)ethenyl]pyrazine is sourced from PubChem (CID 15208513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).