2-(difluoromethyl)-6-(4,4-difluoropiperidin-1-yl)pyrazine

C10H11F4N3 — CID 178072917

IUPAC2-(difluoromethyl)-6-(4,4-difluoropiperidin-1-yl)pyrazine
SMILESFC(F)c1cncc(N2CCC(F)(F)CC2)n1
InChIInChI=1S/C10H11F4N3/c11-9(12)7-5-15-6-8(16-7)17-3-1-10(13,14)2-4-17/h5-6,9H,1-4H2
InChIKeyWQYXIVRTHZHSBS-UHFFFAOYSA-N
MW249.21 g/mol
LogP2.65
Rot. Bonds2

About 2-(difluoromethyl)-6-(4,4-difluoropiperidin-1-yl)pyrazine

2-(difluoromethyl)-6-(4,4-difluoropiperidin-1-yl)pyrazine (PubChem CID 178072917) has the molecular formula C10H11F4N3 and a molecular weight of 249.21 g/mol. Its IUPAC name is 2-(difluoromethyl)-6-(4,4-difluoropiperidin-1-yl)pyrazine.

Molecular Properties

Compound Name2-(difluoromethyl)-6-(4,4-difluoropiperidin-1-yl)pyrazine
PubChem CID178072917
Molecular FormulaC10H11F4N3
Molecular Weight249.21 g/mol
Exact Mass249.09
IUPAC Name2-(difluoromethyl)-6-(4,4-difluoropiperidin-1-yl)pyrazine
SMILESFC(F)c1cncc(N2CCC(F)(F)CC2)n1
InChIInChI=1S/C10H11F4N3/c11-9(12)7-5-15-6-8(16-7)17-3-1-10(13,14)2-4-17/h5-6,9H,1-4H2
InChIKeyWQYXIVRTHZHSBS-UHFFFAOYSA-N
XLogP2.65
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.21
LogP ≤ 52.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-6-(4,4-difluoropiperidin-1-yl)pyrazine?
The IUPAC name of 2-(difluoromethyl)-6-(4,4-difluoropiperidin-1-yl)pyrazine (CID 178072917) is 2-(difluoromethyl)-6-(4,4-difluoropiperidin-1-yl)pyrazine.
What is the SMILES notation for 2-(difluoromethyl)-6-(4,4-difluoropiperidin-1-yl)pyrazine?
The canonical SMILES for 2-(difluoromethyl)-6-(4,4-difluoropiperidin-1-yl)pyrazine is FC(F)c1cncc(N2CCC(F)(F)CC2)n1.
What is the InChIKey of 2-(difluoromethyl)-6-(4,4-difluoropiperidin-1-yl)pyrazine?
The InChIKey is WQYXIVRTHZHSBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F4N3/c11-9(12)7-5-15-6-8(16-7)17-3-1-10(13,14)2-4-17/h5-6,9H,1-4H2.
What are the key properties of 2-(difluoromethyl)-6-(4,4-difluoropiperidin-1-yl)pyrazine?
2-(difluoromethyl)-6-(4,4-difluoropiperidin-1-yl)pyrazine has a molecular weight of 249.21 g/mol, XLogP of 2.65, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)-6-(4,4-difluoropiperidin-1-yl)pyrazine is sourced from PubChem (CID 178072917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).