5-chloroquinolin-8-ol;hydrochloride

C9H7Cl2NO — CID 3015226

IUPAC5-chloroquinolin-8-ol;hydrochloride
SMILESCl.Oc1ccc(Cl)c2cccnc12
InChIInChI=1S/C9H6ClNO.ClH/c10-7-3-4-8(12)9-6(7)2-1-5-11-9;/h1-5,12H;1H
InChIKeyQKWIORGVGGOEFG-UHFFFAOYSA-N
MW216.07 g/mol
LogP3.02
Rot. Bonds

About 5-chloroquinolin-8-ol;hydrochloride

5-chloroquinolin-8-ol;hydrochloride (PubChem CID 3015226) has the molecular formula C9H7Cl2NO and a molecular weight of 216.07 g/mol. Its IUPAC name is 5-chloroquinolin-8-ol;hydrochloride.

Molecular Properties

Compound Name5-chloroquinolin-8-ol;hydrochloride
PubChem CID3015226
Molecular FormulaC9H7Cl2NO
Molecular Weight216.07 g/mol
Exact Mass214.99
IUPAC Name5-chloroquinolin-8-ol;hydrochloride
SMILESCl.Oc1ccc(Cl)c2cccnc12
InChIInChI=1S/C9H6ClNO.ClH/c10-7-3-4-8(12)9-6(7)2-1-5-11-9;/h1-5,12H;1H
InChIKeyQKWIORGVGGOEFG-UHFFFAOYSA-N
XLogP3.02
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.07
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-chloroquinolin-8-ol;hydrochloride?
The IUPAC name of 5-chloroquinolin-8-ol;hydrochloride (CID 3015226) is 5-chloroquinolin-8-ol;hydrochloride.
What is the SMILES notation for 5-chloroquinolin-8-ol;hydrochloride?
The canonical SMILES for 5-chloroquinolin-8-ol;hydrochloride is Cl.Oc1ccc(Cl)c2cccnc12.
What is the InChIKey of 5-chloroquinolin-8-ol;hydrochloride?
The InChIKey is QKWIORGVGGOEFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6ClNO.ClH/c10-7-3-4-8(12)9-6(7)2-1-5-11-9;/h1-5,12H;1H.
What are the key properties of 5-chloroquinolin-8-ol;hydrochloride?
5-chloroquinolin-8-ol;hydrochloride has a molecular weight of 216.07 g/mol, XLogP of 3.02, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloroquinolin-8-ol;hydrochloride is sourced from PubChem (CID 3015226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).