About 6-(5-chlorofuran-2-yl)-3-methoxypyridazin-4-amine
6-(5-chlorofuran-2-yl)-3-methoxypyridazin-4-amine (PubChem CID 117126994) has the molecular formula C9H8ClN3O2
and a molecular weight of 225.64 g/mol. Its IUPAC name is 6-(5-chlorofuran-2-yl)-3-methoxypyridazin-4-amine.
Molecular Properties
| Compound Name | 6-(5-chlorofuran-2-yl)-3-methoxypyridazin-4-amine |
| PubChem CID | 117126994 |
| Molecular Formula | C9H8ClN3O2 |
| Molecular Weight | 225.64 g/mol |
| Exact Mass | 225.03 |
| IUPAC Name | 6-(5-chlorofuran-2-yl)-3-methoxypyridazin-4-amine |
| SMILES | COc1nnc(-c2ccc(Cl)o2)cc1N |
| InChI | InChI=1S/C9H8ClN3O2/c1-14-9-5(11)4-6(12-13-9)7-2-3-8(10)15-7/h2-4H,1H3,(H2,11,12) |
| InChIKey | WQVDFEFMENOYAE-UHFFFAOYSA-N |
| XLogP | 1.98 |
| TPSA | 74.17 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 225.64 |
| LogP ≤ 5 | 1.98 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 5 |
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Frequently Asked Questions
What is the IUPAC name of 6-(5-chlorofuran-2-yl)-3-methoxypyridazin-4-amine?
The IUPAC name of 6-(5-chlorofuran-2-yl)-3-methoxypyridazin-4-amine (CID 117126994) is 6-(5-chlorofuran-2-yl)-3-methoxypyridazin-4-amine.
What is the SMILES notation for 6-(5-chlorofuran-2-yl)-3-methoxypyridazin-4-amine?
The canonical SMILES for 6-(5-chlorofuran-2-yl)-3-methoxypyridazin-4-amine is COc1nnc(-c2ccc(Cl)o2)cc1N.
What is the InChIKey of 6-(5-chlorofuran-2-yl)-3-methoxypyridazin-4-amine?
The InChIKey is WQVDFEFMENOYAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8ClN3O2/c1-14-9-5(11)4-6(12-13-9)7-2-3-8(10)15-7/h2-4H,1H3,(H2,11,12).
What are the key properties of 6-(5-chlorofuran-2-yl)-3-methoxypyridazin-4-amine?
6-(5-chlorofuran-2-yl)-3-methoxypyridazin-4-amine has a molecular weight of 225.64 g/mol, XLogP of 1.98, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-chlorofuran-2-yl)-3-methoxypyridazin-4-amine is sourced from PubChem (CID 117126994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).