About 2-(difluoromethyl)-4-iodo-5-methylpyridin-3-amine
2-(difluoromethyl)-4-iodo-5-methylpyridin-3-amine (PubChem CID 130105197) has the molecular formula C7H7F2IN2
and a molecular weight of 284.05 g/mol. Its IUPAC name is 2-(difluoromethyl)-4-iodo-5-methylpyridin-3-amine.
Molecular Properties
| Compound Name | 2-(difluoromethyl)-4-iodo-5-methylpyridin-3-amine |
| PubChem CID | 130105197 |
| Molecular Formula | C7H7F2IN2 |
| Molecular Weight | 284.05 g/mol |
| Exact Mass | 283.96 |
| IUPAC Name | 2-(difluoromethyl)-4-iodo-5-methylpyridin-3-amine |
| SMILES | Cc1cnc(C(F)F)c(N)c1I |
| InChI | InChI=1S/C7H7F2IN2/c1-3-2-12-6(7(8)9)5(11)4(3)10/h2,7H,11H2,1H3 |
| InChIKey | GFZADOIGHCYQHI-UHFFFAOYSA-N |
| XLogP | 2.51 |
| TPSA | 38.91 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 12 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 284.05 |
| LogP ≤ 5 | 2.51 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'iodine', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 2-(difluoromethyl)-4-iodo-5-methylpyridin-3-amine?
The IUPAC name of 2-(difluoromethyl)-4-iodo-5-methylpyridin-3-amine (CID 130105197) is 2-(difluoromethyl)-4-iodo-5-methylpyridin-3-amine.
What is the SMILES notation for 2-(difluoromethyl)-4-iodo-5-methylpyridin-3-amine?
The canonical SMILES for 2-(difluoromethyl)-4-iodo-5-methylpyridin-3-amine is Cc1cnc(C(F)F)c(N)c1I.
What is the InChIKey of 2-(difluoromethyl)-4-iodo-5-methylpyridin-3-amine?
The InChIKey is GFZADOIGHCYQHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7F2IN2/c1-3-2-12-6(7(8)9)5(11)4(3)10/h2,7H,11H2,1H3.
What are the key properties of 2-(difluoromethyl)-4-iodo-5-methylpyridin-3-amine?
2-(difluoromethyl)-4-iodo-5-methylpyridin-3-amine has a molecular weight of 284.05 g/mol, XLogP of 2.51, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)-4-iodo-5-methylpyridin-3-amine is sourced from PubChem (CID 130105197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).