5-cyclopentylsulfonylquinolin-8-ol

C14H15NO3S — CID 122441915

IUPAC5-cyclopentylsulfonylquinolin-8-ol
SMILESO=S(=O)(c1ccc(O)c2ncccc12)C1CCCC1
InChIInChI=1S/C14H15NO3S/c16-12-7-8-13(11-6-3-9-15-14(11)12)19(17,18)10-4-1-2-5-10/h3,6-10,16H,1-2,4-5H2
InChIKeyRRXFHJFZWNODIX-UHFFFAOYSA-N
MW277.34 g/mol
LogP2.66
Rot. Bonds2

About 5-cyclopentylsulfonylquinolin-8-ol

5-cyclopentylsulfonylquinolin-8-ol (PubChem CID 122441915) has the molecular formula C14H15NO3S and a molecular weight of 277.34 g/mol. Its IUPAC name is 5-cyclopentylsulfonylquinolin-8-ol.

Molecular Properties

Compound Name5-cyclopentylsulfonylquinolin-8-ol
PubChem CID122441915
Molecular FormulaC14H15NO3S
Molecular Weight277.34 g/mol
Exact Mass277.08
IUPAC Name5-cyclopentylsulfonylquinolin-8-ol
SMILESO=S(=O)(c1ccc(O)c2ncccc12)C1CCCC1
InChIInChI=1S/C14H15NO3S/c16-12-7-8-13(11-6-3-9-15-14(11)12)19(17,18)10-4-1-2-5-10/h3,6-10,16H,1-2,4-5H2
InChIKeyRRXFHJFZWNODIX-UHFFFAOYSA-N
XLogP2.66
TPSA67.26 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.34
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopentylsulfonylquinolin-8-ol?
The IUPAC name of 5-cyclopentylsulfonylquinolin-8-ol (CID 122441915) is 5-cyclopentylsulfonylquinolin-8-ol.
What is the SMILES notation for 5-cyclopentylsulfonylquinolin-8-ol?
The canonical SMILES for 5-cyclopentylsulfonylquinolin-8-ol is O=S(=O)(c1ccc(O)c2ncccc12)C1CCCC1.
What is the InChIKey of 5-cyclopentylsulfonylquinolin-8-ol?
The InChIKey is RRXFHJFZWNODIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO3S/c16-12-7-8-13(11-6-3-9-15-14(11)12)19(17,18)10-4-1-2-5-10/h3,6-10,16H,1-2,4-5H2.
What are the key properties of 5-cyclopentylsulfonylquinolin-8-ol?
5-cyclopentylsulfonylquinolin-8-ol has a molecular weight of 277.34 g/mol, XLogP of 2.66, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopentylsulfonylquinolin-8-ol is sourced from PubChem (CID 122441915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).