6,8-diiodoquinoxalin-5-ol

C8H4I2N2O — CID 137126062

IUPAC6,8-diiodoquinoxalin-5-ol
SMILESOc1c(I)cc(I)c2nccnc12
InChIInChI=1S/C8H4I2N2O/c9-4-3-5(10)8(13)7-6(4)11-1-2-12-7/h1-3,13H
InChIKeyMNAASJBOLXPFGH-UHFFFAOYSA-N
MW397.94 g/mol
LogP2.54
Rot. Bonds

About 6,8-diiodoquinoxalin-5-ol

6,8-diiodoquinoxalin-5-ol (PubChem CID 137126062) has the molecular formula C8H4I2N2O and a molecular weight of 397.94 g/mol. Its IUPAC name is 6,8-diiodoquinoxalin-5-ol.

Molecular Properties

Compound Name6,8-diiodoquinoxalin-5-ol
PubChem CID137126062
Molecular FormulaC8H4I2N2O
Molecular Weight397.94 g/mol
Exact Mass397.84
IUPAC Name6,8-diiodoquinoxalin-5-ol
SMILESOc1c(I)cc(I)c2nccnc12
InChIInChI=1S/C8H4I2N2O/c9-4-3-5(10)8(13)7-6(4)11-1-2-12-7/h1-3,13H
InChIKeyMNAASJBOLXPFGH-UHFFFAOYSA-N
XLogP2.54
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.94
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-Phenazinol
CID 135412648
1,6-Dihydroxyphenazine
CID 135514780
5-Quinoxalinol
CID 135690274
6-Quinoxalinol
CID 135420609
6,8-Diiodo-2,3-dimethylquinoxalin-5-ol
CID 137126069
5-Methylphenazin-10-ium-1-one
CID 135495419
2,4-Diiodophenazin-1-ol
CID 137126055
6,8-Dibromoquinoxalin-5-ol
CID 137126066
2,3-Dimethylquinoxalin-5-ol
CID 136030555
2,3-Dimethyl-1,4-dioxidoquinoxaline-1,4-diium-5-ol
CID 137185439
1,8-Phenazinediol
CID 135692478
Phenazine-1,4-diol
CID 135452589

Frequently Asked Questions

What is the IUPAC name of 6,8-diiodoquinoxalin-5-ol?
The IUPAC name of 6,8-diiodoquinoxalin-5-ol (CID 137126062) is 6,8-diiodoquinoxalin-5-ol.
What is the SMILES notation for 6,8-diiodoquinoxalin-5-ol?
The canonical SMILES for 6,8-diiodoquinoxalin-5-ol is Oc1c(I)cc(I)c2nccnc12.
What is the InChIKey of 6,8-diiodoquinoxalin-5-ol?
The InChIKey is MNAASJBOLXPFGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H4I2N2O/c9-4-3-5(10)8(13)7-6(4)11-1-2-12-7/h1-3,13H.
What are the key properties of 6,8-diiodoquinoxalin-5-ol?
6,8-diiodoquinoxalin-5-ol has a molecular weight of 397.94 g/mol, XLogP of 2.54, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6,8-diiodoquinoxalin-5-ol is sourced from PubChem (CID 137126062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).