4-fluoropyridine-2,6-dicarbonitrile

C7H2FN3 — CID 175672759

IUPAC4-fluoropyridine-2,6-dicarbonitrile
SMILESN#Cc1cc(F)cc(C#N)n1
InChIInChI=1S/C7H2FN3/c8-5-1-6(3-9)11-7(2-5)4-10/h1-2H
InChIKeyOYXYUVMEIMAJAW-UHFFFAOYSA-N
MW147.11 g/mol
LogP0.96
Rot. Bonds

About 4-fluoropyridine-2,6-dicarbonitrile

4-fluoropyridine-2,6-dicarbonitrile (PubChem CID 175672759) has the molecular formula C7H2FN3 and a molecular weight of 147.11 g/mol. Its IUPAC name is 4-fluoropyridine-2,6-dicarbonitrile.

Molecular Properties

Compound Name4-fluoropyridine-2,6-dicarbonitrile
PubChem CID175672759
Molecular FormulaC7H2FN3
Molecular Weight147.11 g/mol
Exact Mass147.02
IUPAC Name4-fluoropyridine-2,6-dicarbonitrile
SMILESN#Cc1cc(F)cc(C#N)n1
InChIInChI=1S/C7H2FN3/c8-5-1-6(3-9)11-7(2-5)4-10/h1-2H
InChIKeyOYXYUVMEIMAJAW-UHFFFAOYSA-N
XLogP0.96
TPSA60.47 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.11
LogP ≤ 50.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-fluoropyridine-2,6-dicarbonitrile?
The IUPAC name of 4-fluoropyridine-2,6-dicarbonitrile (CID 175672759) is 4-fluoropyridine-2,6-dicarbonitrile.
What is the SMILES notation for 4-fluoropyridine-2,6-dicarbonitrile?
The canonical SMILES for 4-fluoropyridine-2,6-dicarbonitrile is N#Cc1cc(F)cc(C#N)n1.
What is the InChIKey of 4-fluoropyridine-2,6-dicarbonitrile?
The InChIKey is OYXYUVMEIMAJAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H2FN3/c8-5-1-6(3-9)11-7(2-5)4-10/h1-2H.
What are the key properties of 4-fluoropyridine-2,6-dicarbonitrile?
4-fluoropyridine-2,6-dicarbonitrile has a molecular weight of 147.11 g/mol, XLogP of 0.96, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoropyridine-2,6-dicarbonitrile is sourced from PubChem (CID 175672759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).