4-fluoro-2-(triazol-1-yl)pyridine

C7H5FN4 — CID 142795340

IUPAC4-fluoro-2-(triazol-1-yl)pyridine
SMILESFc1ccnc(-n2ccnn2)c1
InChIInChI=1S/C7H5FN4/c8-6-1-2-9-7(5-6)12-4-3-10-11-12/h1-5H
InChIKeyIPHFPASUPZFFMI-UHFFFAOYSA-N
MW164.14 g/mol
LogP0.80
Rot. Bonds1

About 4-fluoro-2-(triazol-1-yl)pyridine

4-fluoro-2-(triazol-1-yl)pyridine (PubChem CID 142795340) has the molecular formula C7H5FN4 and a molecular weight of 164.14 g/mol. Its IUPAC name is 4-fluoro-2-(triazol-1-yl)pyridine.

Molecular Properties

Compound Name4-fluoro-2-(triazol-1-yl)pyridine
PubChem CID142795340
Molecular FormulaC7H5FN4
Molecular Weight164.14 g/mol
Exact Mass164.05
IUPAC Name4-fluoro-2-(triazol-1-yl)pyridine
SMILESFc1ccnc(-n2ccnn2)c1
InChIInChI=1S/C7H5FN4/c8-6-1-2-9-7(5-6)12-4-3-10-11-12/h1-5H
InChIKeyIPHFPASUPZFFMI-UHFFFAOYSA-N
XLogP0.80
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.14
LogP ≤ 50.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-2-(triazol-1-yl)pyridine?
The IUPAC name of 4-fluoro-2-(triazol-1-yl)pyridine (CID 142795340) is 4-fluoro-2-(triazol-1-yl)pyridine.
What is the SMILES notation for 4-fluoro-2-(triazol-1-yl)pyridine?
The canonical SMILES for 4-fluoro-2-(triazol-1-yl)pyridine is Fc1ccnc(-n2ccnn2)c1.
What is the InChIKey of 4-fluoro-2-(triazol-1-yl)pyridine?
The InChIKey is IPHFPASUPZFFMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5FN4/c8-6-1-2-9-7(5-6)12-4-3-10-11-12/h1-5H.
What are the key properties of 4-fluoro-2-(triazol-1-yl)pyridine?
4-fluoro-2-(triazol-1-yl)pyridine has a molecular weight of 164.14 g/mol, XLogP of 0.80, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-2-(triazol-1-yl)pyridine is sourced from PubChem (CID 142795340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).