5,7-diiodoquinolin-8-ol

C9H5I2NO — CID 3728

💊View drug profile → diiodohydroxyquinoline
IUPAC5,7-diiodoquinolin-8-ol
SMILESOc1c(I)cc(I)c2cccnc12
InChIInChI=1S/C9H5I2NO/c10-6-4-7(11)9(13)8-5(6)2-1-3-12-8/h1-4,13H
InChIKeyUXZFQZANDVDGMM-UHFFFAOYSA-N
MW396.95 g/mol
LogP3.15
Rot. Bonds

About 5,7-diiodoquinolin-8-ol

5,7-diiodoquinolin-8-ol (PubChem CID 3728) has the molecular formula C9H5I2NO and a molecular weight of 396.95 g/mol. Its IUPAC name is 5,7-diiodoquinolin-8-ol.

Molecular Properties

Compound Name5,7-diiodoquinolin-8-ol
PubChem CID3728
Molecular FormulaC9H5I2NO
Molecular Weight396.95 g/mol
Exact Mass396.85
IUPAC Name5,7-diiodoquinolin-8-ol
SMILESOc1c(I)cc(I)c2cccnc12
InChIInChI=1S/C9H5I2NO/c10-6-4-7(11)9(13)8-5(6)2-1-3-12-8/h1-4,13H
InChIKeyUXZFQZANDVDGMM-UHFFFAOYSA-N
XLogP3.15
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.95
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

Clioquinol
CID 2788
8-Hydroxyquinoline
CID 1923
Nitroxoline
CID 19910
Broxyquinoline
CID 2453
Oxine-copper
CID 3032555
5-Nitroso-8-quinolinol
CID 19103
Hydroxyquinoline sulfate
CID 517000
5-Chloro-8-hydroxyquinoline
CID 2817
Ferron
CID 11043
8-Hydroxyquinoline N-oxide
CID 14312
7-Hydroxyquinoline
CID 135426866
5-Amino-8-hydroxyquinoline
CID 416002

Frequently Asked Questions

What is the IUPAC name of 5,7-diiodoquinolin-8-ol?
The IUPAC name of 5,7-diiodoquinolin-8-ol (CID 3728) is 5,7-diiodoquinolin-8-ol.
What is the SMILES notation for 5,7-diiodoquinolin-8-ol?
The canonical SMILES for 5,7-diiodoquinolin-8-ol is Oc1c(I)cc(I)c2cccnc12.
What is the InChIKey of 5,7-diiodoquinolin-8-ol?
The InChIKey is UXZFQZANDVDGMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H5I2NO/c10-6-4-7(11)9(13)8-5(6)2-1-3-12-8/h1-4,13H.
What are the key properties of 5,7-diiodoquinolin-8-ol?
5,7-diiodoquinolin-8-ol has a molecular weight of 396.95 g/mol, XLogP of 3.15, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-diiodoquinolin-8-ol is sourced from PubChem (CID 3728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).