6-bromo-5-hydroxy-4-iodopyridine-2-carbaldehyde

C6H3BrINO2 — CID 71299111

IUPAC6-bromo-5-hydroxy-4-iodopyridine-2-carbaldehyde
SMILESO=Cc1cc(I)c(O)c(Br)n1
InChIInChI=1S/C6H3BrINO2/c7-6-5(11)4(8)1-3(2-10)9-6/h1-2,11H
InChIKeyFOMPDHJYDDSBST-UHFFFAOYSA-N
MW327.90 g/mol
LogP1.97
Rot. Bonds1

About 6-bromo-5-hydroxy-4-iodopyridine-2-carbaldehyde

6-bromo-5-hydroxy-4-iodopyridine-2-carbaldehyde (PubChem CID 71299111) has the molecular formula C6H3BrINO2 and a molecular weight of 327.90 g/mol. Its IUPAC name is 6-bromo-5-hydroxy-4-iodopyridine-2-carbaldehyde.

Molecular Properties

Compound Name6-bromo-5-hydroxy-4-iodopyridine-2-carbaldehyde
PubChem CID71299111
Molecular FormulaC6H3BrINO2
Molecular Weight327.90 g/mol
Exact Mass326.84
IUPAC Name6-bromo-5-hydroxy-4-iodopyridine-2-carbaldehyde
SMILESO=Cc1cc(I)c(O)c(Br)n1
InChIInChI=1S/C6H3BrINO2/c7-6-5(11)4(8)1-3(2-10)9-6/h1-2,11H
InChIKeyFOMPDHJYDDSBST-UHFFFAOYSA-N
XLogP1.97
TPSA50.19 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.90
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

Analyze 6-bromo-5-hydroxy-4-iodopyridine-2-carbaldehyde with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-bromo-5-hydroxy-4-iodopyridine-2-carbaldehyde?
The IUPAC name of 6-bromo-5-hydroxy-4-iodopyridine-2-carbaldehyde (CID 71299111) is 6-bromo-5-hydroxy-4-iodopyridine-2-carbaldehyde.
What is the SMILES notation for 6-bromo-5-hydroxy-4-iodopyridine-2-carbaldehyde?
The canonical SMILES for 6-bromo-5-hydroxy-4-iodopyridine-2-carbaldehyde is O=Cc1cc(I)c(O)c(Br)n1.
What is the InChIKey of 6-bromo-5-hydroxy-4-iodopyridine-2-carbaldehyde?
The InChIKey is FOMPDHJYDDSBST-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3BrINO2/c7-6-5(11)4(8)1-3(2-10)9-6/h1-2,11H.
What are the key properties of 6-bromo-5-hydroxy-4-iodopyridine-2-carbaldehyde?
6-bromo-5-hydroxy-4-iodopyridine-2-carbaldehyde has a molecular weight of 327.90 g/mol, XLogP of 1.97, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-5-hydroxy-4-iodopyridine-2-carbaldehyde is sourced from PubChem (CID 71299111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).