About 7-iodo-2-pyridin-2-ylfuro[3,2-b]pyridine
7-iodo-2-pyridin-2-ylfuro[3,2-b]pyridine (PubChem CID 134901945) has the molecular formula C12H7IN2O
and a molecular weight of 322.11 g/mol. Its IUPAC name is 7-iodo-2-pyridin-2-ylfuro[3,2-b]pyridine.
Molecular Properties
| Compound Name | 7-iodo-2-pyridin-2-ylfuro[3,2-b]pyridine |
| PubChem CID | 134901945 |
| Molecular Formula | C12H7IN2O |
| Molecular Weight | 322.11 g/mol |
| Exact Mass | 321.96 |
| IUPAC Name | 7-iodo-2-pyridin-2-ylfuro[3,2-b]pyridine |
| SMILES | Ic1ccnc2cc(-c3ccccn3)oc12 |
| InChI | InChI=1S/C12H7IN2O/c13-8-4-6-15-10-7-11(16-12(8)10)9-3-1-2-5-14-9/h1-7H |
| InChIKey | UIIFWXVKPBLJJU-UHFFFAOYSA-N |
| XLogP | 3.49 |
| TPSA | 38.92 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 322.11 |
| LogP ≤ 5 | 3.49 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'iodine', 'substructure': 'N/A'} |
|---|
Analyze 7-iodo-2-pyridin-2-ylfuro[3,2-b]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 7-iodo-2-pyridin-2-ylfuro[3,2-b]pyridine?
The IUPAC name of 7-iodo-2-pyridin-2-ylfuro[3,2-b]pyridine (CID 134901945) is 7-iodo-2-pyridin-2-ylfuro[3,2-b]pyridine.
What is the SMILES notation for 7-iodo-2-pyridin-2-ylfuro[3,2-b]pyridine?
The canonical SMILES for 7-iodo-2-pyridin-2-ylfuro[3,2-b]pyridine is Ic1ccnc2cc(-c3ccccn3)oc12.
What is the InChIKey of 7-iodo-2-pyridin-2-ylfuro[3,2-b]pyridine?
The InChIKey is UIIFWXVKPBLJJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7IN2O/c13-8-4-6-15-10-7-11(16-12(8)10)9-3-1-2-5-14-9/h1-7H.
What are the key properties of 7-iodo-2-pyridin-2-ylfuro[3,2-b]pyridine?
7-iodo-2-pyridin-2-ylfuro[3,2-b]pyridine has a molecular weight of 322.11 g/mol, XLogP of 3.49, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-iodo-2-pyridin-2-ylfuro[3,2-b]pyridine is sourced from PubChem (CID 134901945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).