2-fluoro-5-(2-methylsulfonylethoxy)pyridine

C8H10FNO3S — CID 115371703

IUPAC2-fluoro-5-(2-methylsulfonylethoxy)pyridine
SMILESCS(=O)(=O)CCOc1ccc(F)nc1
InChIInChI=1S/C8H10FNO3S/c1-14(11,12)5-4-13-7-2-3-8(9)10-6-7/h2-3,6H,4-5H2,1H3
InChIKeyYBTJPDCZEZXKGZ-UHFFFAOYSA-N
MW219.24 g/mol
LogP0.64
Rot. Bonds4

About 2-fluoro-5-(2-methylsulfonylethoxy)pyridine

2-fluoro-5-(2-methylsulfonylethoxy)pyridine (PubChem CID 115371703) has the molecular formula C8H10FNO3S and a molecular weight of 219.24 g/mol. Its IUPAC name is 2-fluoro-5-(2-methylsulfonylethoxy)pyridine.

Molecular Properties

Compound Name2-fluoro-5-(2-methylsulfonylethoxy)pyridine
PubChem CID115371703
Molecular FormulaC8H10FNO3S
Molecular Weight219.24 g/mol
Exact Mass219.04
IUPAC Name2-fluoro-5-(2-methylsulfonylethoxy)pyridine
SMILESCS(=O)(=O)CCOc1ccc(F)nc1
InChIInChI=1S/C8H10FNO3S/c1-14(11,12)5-4-13-7-2-3-8(9)10-6-7/h2-3,6H,4-5H2,1H3
InChIKeyYBTJPDCZEZXKGZ-UHFFFAOYSA-N
XLogP0.64
TPSA56.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.24
LogP ≤ 50.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(bromomethyl)-5-(3-methylsulfonylpropoxy)pyridine
CID 79799571
2-fluoro-5-hexoxypyridine
CID 115371648
2-fluoro-5-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pyridine
CID 112592625
1-(2-methylsulfonylethoxy)-4-propan-2-ylbenzene
CID 64763839
2-fluoro-5-[2-(2-methylpropoxy)ethoxy]pyridine
CID 106459965
2-fluoro-5-[3-(2-methoxyethoxy)propoxy]pyridine
CID 103415782
(1R)-1-[4-(2-methylsulfonylethoxy)phenyl]ethanol
CID 63364098
2-[(6-fluoro-3-pyridinyl)oxy]-N-methylacetamide
CID 115371615
2-fluoro-5-(2-phenylsulfanylethoxy)pyridine
CID 115371564
5-[(E)-but-2-enoxy]-2-fluoropyridine
CID 115371580
[2-methyl-4-(2-methylsulfonylethoxy)phenyl]boronic acid
CID 83140998
5-(2-tert-butylsulfonylethoxy)-2-chloropyridine
CID 106735269

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-5-(2-methylsulfonylethoxy)pyridine?
The IUPAC name of 2-fluoro-5-(2-methylsulfonylethoxy)pyridine (CID 115371703) is 2-fluoro-5-(2-methylsulfonylethoxy)pyridine.
What is the SMILES notation for 2-fluoro-5-(2-methylsulfonylethoxy)pyridine?
The canonical SMILES for 2-fluoro-5-(2-methylsulfonylethoxy)pyridine is CS(=O)(=O)CCOc1ccc(F)nc1.
What is the InChIKey of 2-fluoro-5-(2-methylsulfonylethoxy)pyridine?
The InChIKey is YBTJPDCZEZXKGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10FNO3S/c1-14(11,12)5-4-13-7-2-3-8(9)10-6-7/h2-3,6H,4-5H2,1H3.
What are the key properties of 2-fluoro-5-(2-methylsulfonylethoxy)pyridine?
2-fluoro-5-(2-methylsulfonylethoxy)pyridine has a molecular weight of 219.24 g/mol, XLogP of 0.64, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-5-(2-methylsulfonylethoxy)pyridine is sourced from PubChem (CID 115371703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).