2-fluoro-5-pyrazol-1-ylpyridine

C8H6FN3 — CID 141212781

IUPAC2-fluoro-5-pyrazol-1-ylpyridine
SMILESFc1ccc(-n2cccn2)cn1
InChIInChI=1S/C8H6FN3/c9-8-3-2-7(6-10-8)12-5-1-4-11-12/h1-6H
InChIKeyPBPDSUKUJBRHGS-UHFFFAOYSA-N
MW163.15 g/mol
LogP1.41
Rot. Bonds1

About 2-fluoro-5-pyrazol-1-ylpyridine

2-fluoro-5-pyrazol-1-ylpyridine (PubChem CID 141212781) has the molecular formula C8H6FN3 and a molecular weight of 163.15 g/mol. Its IUPAC name is 2-fluoro-5-pyrazol-1-ylpyridine.

Molecular Properties

Compound Name2-fluoro-5-pyrazol-1-ylpyridine
PubChem CID141212781
Molecular FormulaC8H6FN3
Molecular Weight163.15 g/mol
Exact Mass163.05
IUPAC Name2-fluoro-5-pyrazol-1-ylpyridine
SMILESFc1ccc(-n2cccn2)cn1
InChIInChI=1S/C8H6FN3/c9-8-3-2-7(6-10-8)12-5-1-4-11-12/h1-6H
InChIKeyPBPDSUKUJBRHGS-UHFFFAOYSA-N
XLogP1.41
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.15
LogP ≤ 51.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-5-pyrazol-1-ylpyridine?
The IUPAC name of 2-fluoro-5-pyrazol-1-ylpyridine (CID 141212781) is 2-fluoro-5-pyrazol-1-ylpyridine.
What is the SMILES notation for 2-fluoro-5-pyrazol-1-ylpyridine?
The canonical SMILES for 2-fluoro-5-pyrazol-1-ylpyridine is Fc1ccc(-n2cccn2)cn1.
What is the InChIKey of 2-fluoro-5-pyrazol-1-ylpyridine?
The InChIKey is PBPDSUKUJBRHGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6FN3/c9-8-3-2-7(6-10-8)12-5-1-4-11-12/h1-6H.
What are the key properties of 2-fluoro-5-pyrazol-1-ylpyridine?
2-fluoro-5-pyrazol-1-ylpyridine has a molecular weight of 163.15 g/mol, XLogP of 1.41, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-5-pyrazol-1-ylpyridine is sourced from PubChem (CID 141212781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).