2-fluoro-5-iodopyridine-3-carbaldehyde

C6H3FINO — CID 126569658

IUPAC2-fluoro-5-iodopyridine-3-carbaldehyde
SMILESO=Cc1cc(I)cnc1F
InChIInChI=1S/C6H3FINO/c7-6-4(3-10)1-5(8)2-9-6/h1-3H
InChIKeyCJJRKONHJAZYHK-UHFFFAOYSA-N
MW251.00 g/mol
LogP1.64
Rot. Bonds1

About 2-fluoro-5-iodopyridine-3-carbaldehyde

2-fluoro-5-iodopyridine-3-carbaldehyde (PubChem CID 126569658) has the molecular formula C6H3FINO and a molecular weight of 251.00 g/mol. Its IUPAC name is 2-fluoro-5-iodopyridine-3-carbaldehyde.

Molecular Properties

Compound Name2-fluoro-5-iodopyridine-3-carbaldehyde
PubChem CID126569658
Molecular FormulaC6H3FINO
Molecular Weight251.00 g/mol
Exact Mass250.92
IUPAC Name2-fluoro-5-iodopyridine-3-carbaldehyde
SMILESO=Cc1cc(I)cnc1F
InChIInChI=1S/C6H3FINO/c7-6-4(3-10)1-5(8)2-9-6/h1-3H
InChIKeyCJJRKONHJAZYHK-UHFFFAOYSA-N
XLogP1.64
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.00
LogP ≤ 51.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 2-fluoro-5-iodopyridine-3-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 2-fluoro-5-iodopyridine-3-carbaldehyde?
The IUPAC name of 2-fluoro-5-iodopyridine-3-carbaldehyde (CID 126569658) is 2-fluoro-5-iodopyridine-3-carbaldehyde.
What is the SMILES notation for 2-fluoro-5-iodopyridine-3-carbaldehyde?
The canonical SMILES for 2-fluoro-5-iodopyridine-3-carbaldehyde is O=Cc1cc(I)cnc1F.
What is the InChIKey of 2-fluoro-5-iodopyridine-3-carbaldehyde?
The InChIKey is CJJRKONHJAZYHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H3FINO/c7-6-4(3-10)1-5(8)2-9-6/h1-3H.
What are the key properties of 2-fluoro-5-iodopyridine-3-carbaldehyde?
2-fluoro-5-iodopyridine-3-carbaldehyde has a molecular weight of 251.00 g/mol, XLogP of 1.64, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-5-iodopyridine-3-carbaldehyde is sourced from PubChem (CID 126569658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).