About 2-fluoro-4-[2-[2-(2-iodoethoxy)ethoxy]ethoxy]pyridine
2-fluoro-4-[2-[2-(2-iodoethoxy)ethoxy]ethoxy]pyridine (PubChem CID 169211098) has the molecular formula C11H15FINO3
and a molecular weight of 355.15 g/mol. Its IUPAC name is 2-fluoro-4-[2-[2-(2-iodoethoxy)ethoxy]ethoxy]pyridine.
Molecular Properties
| Compound Name | 2-fluoro-4-[2-[2-(2-iodoethoxy)ethoxy]ethoxy]pyridine |
| PubChem CID | 169211098 |
| Molecular Formula | C11H15FINO3 |
| Molecular Weight | 355.15 g/mol |
| Exact Mass | 355.01 |
| IUPAC Name | 2-fluoro-4-[2-[2-(2-iodoethoxy)ethoxy]ethoxy]pyridine |
| SMILES | Fc1cc(OCCOCCOCCI)ccn1 |
| InChI | InChI=1S/C11H15FINO3/c12-11-9-10(1-3-14-11)17-8-7-16-6-5-15-4-2-13/h1,3,9H,2,4-8H2 |
| InChIKey | KRRAUZNLMTVGOI-UHFFFAOYSA-N |
| XLogP | 2.07 |
| TPSA | 40.58 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 355.15 |
| LogP ≤ 5 | 2.07 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 4 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'} |
|---|
Analyze 2-fluoro-4-[2-[2-(2-iodoethoxy)ethoxy]ethoxy]pyridine 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-4-[2-[2-(2-iodoethoxy)ethoxy]ethoxy]pyridine?
The IUPAC name of 2-fluoro-4-[2-[2-(2-iodoethoxy)ethoxy]ethoxy]pyridine (CID 169211098) is 2-fluoro-4-[2-[2-(2-iodoethoxy)ethoxy]ethoxy]pyridine.
What is the SMILES notation for 2-fluoro-4-[2-[2-(2-iodoethoxy)ethoxy]ethoxy]pyridine?
The canonical SMILES for 2-fluoro-4-[2-[2-(2-iodoethoxy)ethoxy]ethoxy]pyridine is Fc1cc(OCCOCCOCCI)ccn1.
What is the InChIKey of 2-fluoro-4-[2-[2-(2-iodoethoxy)ethoxy]ethoxy]pyridine?
The InChIKey is KRRAUZNLMTVGOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15FINO3/c12-11-9-10(1-3-14-11)17-8-7-16-6-5-15-4-2-13/h1,3,9H,2,4-8H2.
What are the key properties of 2-fluoro-4-[2-[2-(2-iodoethoxy)ethoxy]ethoxy]pyridine?
2-fluoro-4-[2-[2-(2-iodoethoxy)ethoxy]ethoxy]pyridine has a molecular weight of 355.15 g/mol, XLogP of 2.07, 9 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-4-[2-[2-(2-iodoethoxy)ethoxy]ethoxy]pyridine is sourced from PubChem (CID 169211098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).