2-(3-fluoro-5-methoxyphenyl)pyrazine

C11H9FN2O — CID 166161834

IUPAC2-(3-fluoro-5-methoxyphenyl)pyrazine
SMILESCOc1cc(F)cc(-c2cnccn2)c1
InChIInChI=1S/C11H9FN2O/c1-15-10-5-8(4-9(12)6-10)11-7-13-2-3-14-11/h2-7H,1H3
InChIKeyBBUFMYQUUJOREV-UHFFFAOYSA-N
MW204.20 g/mol
LogP2.29
Rot. Bonds2

About 2-(3-fluoro-5-methoxyphenyl)pyrazine

2-(3-fluoro-5-methoxyphenyl)pyrazine (PubChem CID 166161834) has the molecular formula C11H9FN2O and a molecular weight of 204.20 g/mol. Its IUPAC name is 2-(3-fluoro-5-methoxyphenyl)pyrazine.

Molecular Properties

Compound Name2-(3-fluoro-5-methoxyphenyl)pyrazine
PubChem CID166161834
Molecular FormulaC11H9FN2O
Molecular Weight204.20 g/mol
Exact Mass204.07
IUPAC Name2-(3-fluoro-5-methoxyphenyl)pyrazine
SMILESCOc1cc(F)cc(-c2cnccn2)c1
InChIInChI=1S/C11H9FN2O/c1-15-10-5-8(4-9(12)6-10)11-7-13-2-3-14-11/h2-7H,1H3
InChIKeyBBUFMYQUUJOREV-UHFFFAOYSA-N
XLogP2.29
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.20
LogP ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-fluoro-5-methoxyphenyl)pyrazine?
The IUPAC name of 2-(3-fluoro-5-methoxyphenyl)pyrazine (CID 166161834) is 2-(3-fluoro-5-methoxyphenyl)pyrazine.
What is the SMILES notation for 2-(3-fluoro-5-methoxyphenyl)pyrazine?
The canonical SMILES for 2-(3-fluoro-5-methoxyphenyl)pyrazine is COc1cc(F)cc(-c2cnccn2)c1.
What is the InChIKey of 2-(3-fluoro-5-methoxyphenyl)pyrazine?
The InChIKey is BBUFMYQUUJOREV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9FN2O/c1-15-10-5-8(4-9(12)6-10)11-7-13-2-3-14-11/h2-7H,1H3.
What are the key properties of 2-(3-fluoro-5-methoxyphenyl)pyrazine?
2-(3-fluoro-5-methoxyphenyl)pyrazine has a molecular weight of 204.20 g/mol, XLogP of 2.29, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluoro-5-methoxyphenyl)pyrazine is sourced from PubChem (CID 166161834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).