2-fluoro-6-pyridin-2-ylsulfanylpyridine

C10H7FN2S — CID 61228221

IUPAC2-fluoro-6-pyridin-2-ylsulfanylpyridine
SMILESFc1cccc(Sc2ccccn2)n1
InChIInChI=1S/C10H7FN2S/c11-8-4-3-6-10(13-8)14-9-5-1-2-7-12-9/h1-7H
InChIKeyZVTBDQDVQKTYTL-UHFFFAOYSA-N
MW206.25 g/mol
LogP2.77
Rot. Bonds2

About 2-fluoro-6-pyridin-2-ylsulfanylpyridine

2-fluoro-6-pyridin-2-ylsulfanylpyridine (PubChem CID 61228221) has the molecular formula C10H7FN2S and a molecular weight of 206.25 g/mol. Its IUPAC name is 2-fluoro-6-pyridin-2-ylsulfanylpyridine.

Molecular Properties

Compound Name2-fluoro-6-pyridin-2-ylsulfanylpyridine
PubChem CID61228221
Molecular FormulaC10H7FN2S
Molecular Weight206.25 g/mol
Exact Mass206.03
IUPAC Name2-fluoro-6-pyridin-2-ylsulfanylpyridine
SMILESFc1cccc(Sc2ccccn2)n1
InChIInChI=1S/C10H7FN2S/c11-8-4-3-6-10(13-8)14-9-5-1-2-7-12-9/h1-7H
InChIKeyZVTBDQDVQKTYTL-UHFFFAOYSA-N
XLogP2.77
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.25
LogP ≤ 52.77
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-6-pyridin-2-ylsulfanylpyridine?
The IUPAC name of 2-fluoro-6-pyridin-2-ylsulfanylpyridine (CID 61228221) is 2-fluoro-6-pyridin-2-ylsulfanylpyridine.
What is the SMILES notation for 2-fluoro-6-pyridin-2-ylsulfanylpyridine?
The canonical SMILES for 2-fluoro-6-pyridin-2-ylsulfanylpyridine is Fc1cccc(Sc2ccccn2)n1.
What is the InChIKey of 2-fluoro-6-pyridin-2-ylsulfanylpyridine?
The InChIKey is ZVTBDQDVQKTYTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7FN2S/c11-8-4-3-6-10(13-8)14-9-5-1-2-7-12-9/h1-7H.
What are the key properties of 2-fluoro-6-pyridin-2-ylsulfanylpyridine?
2-fluoro-6-pyridin-2-ylsulfanylpyridine has a molecular weight of 206.25 g/mol, XLogP of 2.77, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-6-pyridin-2-ylsulfanylpyridine is sourced from PubChem (CID 61228221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).