5-[(2-fluorophenyl)sulfonylmethyl]-1,2-oxazole

C10H8FNO3S — CID 60722728

IUPAC5-[(2-fluorophenyl)sulfonylmethyl]-1,2-oxazole
SMILESO=S(=O)(Cc1ccno1)c1ccccc1F
InChIInChI=1S/C10H8FNO3S/c11-9-3-1-2-4-10(9)16(13,14)7-8-5-6-12-15-8/h1-6H,7H2
InChIKeyYEOCWCIHMRRWCQ-UHFFFAOYSA-N
MW241.24 g/mol
LogP1.79
Rot. Bonds3

About 5-[(2-fluorophenyl)sulfonylmethyl]-1,2-oxazole

5-[(2-fluorophenyl)sulfonylmethyl]-1,2-oxazole (PubChem CID 60722728) has the molecular formula C10H8FNO3S and a molecular weight of 241.24 g/mol. Its IUPAC name is 5-[(2-fluorophenyl)sulfonylmethyl]-1,2-oxazole.

Molecular Properties

Compound Name5-[(2-fluorophenyl)sulfonylmethyl]-1,2-oxazole
PubChem CID60722728
Molecular FormulaC10H8FNO3S
Molecular Weight241.24 g/mol
Exact Mass241.02
IUPAC Name5-[(2-fluorophenyl)sulfonylmethyl]-1,2-oxazole
SMILESO=S(=O)(Cc1ccno1)c1ccccc1F
InChIInChI=1S/C10H8FNO3S/c11-9-3-1-2-4-10(9)16(13,14)7-8-5-6-12-15-8/h1-6H,7H2
InChIKeyYEOCWCIHMRRWCQ-UHFFFAOYSA-N
XLogP1.79
TPSA60.17 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.24
LogP ≤ 51.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 5-[(2-fluorophenyl)sulfonylmethyl]-1,2-oxazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-[(2-fluorophenyl)sulfonylmethyl]-1,2-oxazole?
The IUPAC name of 5-[(2-fluorophenyl)sulfonylmethyl]-1,2-oxazole (CID 60722728) is 5-[(2-fluorophenyl)sulfonylmethyl]-1,2-oxazole.
What is the SMILES notation for 5-[(2-fluorophenyl)sulfonylmethyl]-1,2-oxazole?
The canonical SMILES for 5-[(2-fluorophenyl)sulfonylmethyl]-1,2-oxazole is O=S(=O)(Cc1ccno1)c1ccccc1F.
What is the InChIKey of 5-[(2-fluorophenyl)sulfonylmethyl]-1,2-oxazole?
The InChIKey is YEOCWCIHMRRWCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8FNO3S/c11-9-3-1-2-4-10(9)16(13,14)7-8-5-6-12-15-8/h1-6H,7H2.
What are the key properties of 5-[(2-fluorophenyl)sulfonylmethyl]-1,2-oxazole?
5-[(2-fluorophenyl)sulfonylmethyl]-1,2-oxazole has a molecular weight of 241.24 g/mol, XLogP of 1.79, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-fluorophenyl)sulfonylmethyl]-1,2-oxazole is sourced from PubChem (CID 60722728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).