5-ethylsulfonylquinolin-8-ol

C11H11NO3S — CID 122441954

IUPAC5-ethylsulfonylquinolin-8-ol
SMILESCCS(=O)(=O)c1ccc(O)c2ncccc12
InChIInChI=1S/C11H11NO3S/c1-2-16(14,15)10-6-5-9(13)11-8(10)4-3-7-12-11/h3-7,13H,2H2,1H3
InChIKeyZVIWFUADCRHDPT-UHFFFAOYSA-N
MW237.28 g/mol
LogP1.73
Rot. Bonds2

About 5-ethylsulfonylquinolin-8-ol

5-ethylsulfonylquinolin-8-ol (PubChem CID 122441954) has the molecular formula C11H11NO3S and a molecular weight of 237.28 g/mol. Its IUPAC name is 5-ethylsulfonylquinolin-8-ol.

Molecular Properties

Compound Name5-ethylsulfonylquinolin-8-ol
PubChem CID122441954
Molecular FormulaC11H11NO3S
Molecular Weight237.28 g/mol
Exact Mass237.05
IUPAC Name5-ethylsulfonylquinolin-8-ol
SMILESCCS(=O)(=O)c1ccc(O)c2ncccc12
InChIInChI=1S/C11H11NO3S/c1-2-16(14,15)10-6-5-9(13)11-8(10)4-3-7-12-11/h3-7,13H,2H2,1H3
InChIKeyZVIWFUADCRHDPT-UHFFFAOYSA-N
XLogP1.73
TPSA67.26 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.28
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-ethylsulfonylquinolin-8-ol?
The IUPAC name of 5-ethylsulfonylquinolin-8-ol (CID 122441954) is 5-ethylsulfonylquinolin-8-ol.
What is the SMILES notation for 5-ethylsulfonylquinolin-8-ol?
The canonical SMILES for 5-ethylsulfonylquinolin-8-ol is CCS(=O)(=O)c1ccc(O)c2ncccc12.
What is the InChIKey of 5-ethylsulfonylquinolin-8-ol?
The InChIKey is ZVIWFUADCRHDPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO3S/c1-2-16(14,15)10-6-5-9(13)11-8(10)4-3-7-12-11/h3-7,13H,2H2,1H3.
What are the key properties of 5-ethylsulfonylquinolin-8-ol?
5-ethylsulfonylquinolin-8-ol has a molecular weight of 237.28 g/mol, XLogP of 1.73, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethylsulfonylquinolin-8-ol is sourced from PubChem (CID 122441954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).