2-chloro-6-(4-fluoropiperidin-1-yl)pyrazine

C9H11ClFN3 — CID 164651193

IUPAC2-chloro-6-(4-fluoropiperidin-1-yl)pyrazine
SMILESFC1CCN(c2cncc(Cl)n2)CC1
InChIInChI=1S/C9H11ClFN3/c10-8-5-12-6-9(13-8)14-3-1-7(11)2-4-14/h5-7H,1-4H2
InChIKeyVNWIOJMXEJDFNZ-UHFFFAOYSA-N
MW215.66 g/mol
LogP2.07
Rot. Bonds1

About 2-chloro-6-(4-fluoropiperidin-1-yl)pyrazine

2-chloro-6-(4-fluoropiperidin-1-yl)pyrazine (PubChem CID 164651193) has the molecular formula C9H11ClFN3 and a molecular weight of 215.66 g/mol. Its IUPAC name is 2-chloro-6-(4-fluoropiperidin-1-yl)pyrazine.

Molecular Properties

Compound Name2-chloro-6-(4-fluoropiperidin-1-yl)pyrazine
PubChem CID164651193
Molecular FormulaC9H11ClFN3
Molecular Weight215.66 g/mol
Exact Mass215.06
IUPAC Name2-chloro-6-(4-fluoropiperidin-1-yl)pyrazine
SMILESFC1CCN(c2cncc(Cl)n2)CC1
InChIInChI=1S/C9H11ClFN3/c10-8-5-12-6-9(13-8)14-3-1-7(11)2-4-14/h5-7H,1-4H2
InChIKeyVNWIOJMXEJDFNZ-UHFFFAOYSA-N
XLogP2.07
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.66
LogP ≤ 52.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-(4-fluoropiperidin-1-yl)pyrazine?
The IUPAC name of 2-chloro-6-(4-fluoropiperidin-1-yl)pyrazine (CID 164651193) is 2-chloro-6-(4-fluoropiperidin-1-yl)pyrazine.
What is the SMILES notation for 2-chloro-6-(4-fluoropiperidin-1-yl)pyrazine?
The canonical SMILES for 2-chloro-6-(4-fluoropiperidin-1-yl)pyrazine is FC1CCN(c2cncc(Cl)n2)CC1.
What is the InChIKey of 2-chloro-6-(4-fluoropiperidin-1-yl)pyrazine?
The InChIKey is VNWIOJMXEJDFNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11ClFN3/c10-8-5-12-6-9(13-8)14-3-1-7(11)2-4-14/h5-7H,1-4H2.
What are the key properties of 2-chloro-6-(4-fluoropiperidin-1-yl)pyrazine?
2-chloro-6-(4-fluoropiperidin-1-yl)pyrazine has a molecular weight of 215.66 g/mol, XLogP of 2.07, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-(4-fluoropiperidin-1-yl)pyrazine is sourced from PubChem (CID 164651193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).