2-thiophen-2-ylquinolin-8-ol

C13H9NOS — CID 54347575

IUPAC2-thiophen-2-ylquinolin-8-ol
SMILESOc1cccc2ccc(-c3cccs3)nc12
InChIInChI=1S/C13H9NOS/c15-11-4-1-3-9-6-7-10(14-13(9)11)12-5-2-8-16-12/h1-8,15H
InChIKeyUDJHXJUIFVTHDA-UHFFFAOYSA-N
MW227.29 g/mol
LogP3.67
Rot. Bonds1

About 2-thiophen-2-ylquinolin-8-ol

2-thiophen-2-ylquinolin-8-ol (PubChem CID 54347575) has the molecular formula C13H9NOS and a molecular weight of 227.29 g/mol. Its IUPAC name is 2-thiophen-2-ylquinolin-8-ol.

Molecular Properties

Compound Name2-thiophen-2-ylquinolin-8-ol
PubChem CID54347575
Molecular FormulaC13H9NOS
Molecular Weight227.29 g/mol
Exact Mass227.04
IUPAC Name2-thiophen-2-ylquinolin-8-ol
SMILESOc1cccc2ccc(-c3cccs3)nc12
InChIInChI=1S/C13H9NOS/c15-11-4-1-3-9-6-7-10(14-13(9)11)12-5-2-8-16-12/h1-8,15H
InChIKeyUDJHXJUIFVTHDA-UHFFFAOYSA-N
XLogP3.67
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.29
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-thiophen-2-ylquinolin-8-ol?
The IUPAC name of 2-thiophen-2-ylquinolin-8-ol (CID 54347575) is 2-thiophen-2-ylquinolin-8-ol.
What is the SMILES notation for 2-thiophen-2-ylquinolin-8-ol?
The canonical SMILES for 2-thiophen-2-ylquinolin-8-ol is Oc1cccc2ccc(-c3cccs3)nc12.
What is the InChIKey of 2-thiophen-2-ylquinolin-8-ol?
The InChIKey is UDJHXJUIFVTHDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9NOS/c15-11-4-1-3-9-6-7-10(14-13(9)11)12-5-2-8-16-12/h1-8,15H.
What are the key properties of 2-thiophen-2-ylquinolin-8-ol?
2-thiophen-2-ylquinolin-8-ol has a molecular weight of 227.29 g/mol, XLogP of 3.67, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-thiophen-2-ylquinolin-8-ol is sourced from PubChem (CID 54347575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).