2-(1,1-difluoroethyl)pyrazine

C6H6F2N2 — CID 19763564

IUPAC2-(1,1-difluoroethyl)pyrazine
SMILESCC(F)(F)c1cnccn1
InChIInChI=1S/C6H6F2N2/c1-6(7,8)5-4-9-2-3-10-5/h2-4H,1H3
InChIKeyOXKFWGSACYGCSY-UHFFFAOYSA-N
MW144.12 g/mol
LogP1.59
Rot. Bonds1

About 2-(1,1-difluoroethyl)pyrazine

2-(1,1-difluoroethyl)pyrazine (PubChem CID 19763564) has the molecular formula C6H6F2N2 and a molecular weight of 144.12 g/mol. Its IUPAC name is 2-(1,1-difluoroethyl)pyrazine.

Molecular Properties

Compound Name2-(1,1-difluoroethyl)pyrazine
PubChem CID19763564
Molecular FormulaC6H6F2N2
Molecular Weight144.12 g/mol
Exact Mass144.05
IUPAC Name2-(1,1-difluoroethyl)pyrazine
SMILESCC(F)(F)c1cnccn1
InChIInChI=1S/C6H6F2N2/c1-6(7,8)5-4-9-2-3-10-5/h2-4H,1H3
InChIKeyOXKFWGSACYGCSY-UHFFFAOYSA-N
XLogP1.59
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.12
LogP ≤ 51.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(1,1-difluoroethyl)pyrazine?
The IUPAC name of 2-(1,1-difluoroethyl)pyrazine (CID 19763564) is 2-(1,1-difluoroethyl)pyrazine.
What is the SMILES notation for 2-(1,1-difluoroethyl)pyrazine?
The canonical SMILES for 2-(1,1-difluoroethyl)pyrazine is CC(F)(F)c1cnccn1.
What is the InChIKey of 2-(1,1-difluoroethyl)pyrazine?
The InChIKey is OXKFWGSACYGCSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6F2N2/c1-6(7,8)5-4-9-2-3-10-5/h2-4H,1H3.
What are the key properties of 2-(1,1-difluoroethyl)pyrazine?
2-(1,1-difluoroethyl)pyrazine has a molecular weight of 144.12 g/mol, XLogP of 1.59, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,1-difluoroethyl)pyrazine is sourced from PubChem (CID 19763564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).