About 6-[4-(1H-pyrazol-4-yl)-1H-indazol-7-yl]pyridazin-3-amine
6-[4-(1H-pyrazol-4-yl)-1H-indazol-7-yl]pyridazin-3-amine (PubChem CID 156845705) has the molecular formula C14H11N7
and a molecular weight of 277.29 g/mol. Its IUPAC name is 6-[4-(1H-pyrazol-4-yl)-1H-indazol-7-yl]pyridazin-3-amine.
Molecular Properties
| Compound Name | 6-[4-(1H-pyrazol-4-yl)-1H-indazol-7-yl]pyridazin-3-amine |
| PubChem CID | 156845705 |
| Molecular Formula | C14H11N7 |
| Molecular Weight | 277.29 g/mol |
| Exact Mass | 277.11 |
| IUPAC Name | 6-[4-(1H-pyrazol-4-yl)-1H-indazol-7-yl]pyridazin-3-amine |
| SMILES | Nc1ccc(-c2ccc(-c3cn[nH]c3)c3cn[nH]c23)nn1 |
| InChI | InChI=1S/C14H11N7/c15-13-4-3-12(19-20-13)10-2-1-9(8-5-16-17-6-8)11-7-18-21-14(10)11/h1-7H,(H2,15,20)(H,16,17)(H,18,21) |
| InChIKey | OUVYVYZVDGGTJW-UHFFFAOYSA-N |
| XLogP | 1.99 |
| TPSA | 109.16 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 277.29 |
| LogP ≤ 5 | 1.99 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 5 |
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Frequently Asked Questions
What is the IUPAC name of 6-[4-(1H-pyrazol-4-yl)-1H-indazol-7-yl]pyridazin-3-amine?
The IUPAC name of 6-[4-(1H-pyrazol-4-yl)-1H-indazol-7-yl]pyridazin-3-amine (CID 156845705) is 6-[4-(1H-pyrazol-4-yl)-1H-indazol-7-yl]pyridazin-3-amine.
What is the SMILES notation for 6-[4-(1H-pyrazol-4-yl)-1H-indazol-7-yl]pyridazin-3-amine?
The canonical SMILES for 6-[4-(1H-pyrazol-4-yl)-1H-indazol-7-yl]pyridazin-3-amine is Nc1ccc(-c2ccc(-c3cn[nH]c3)c3cn[nH]c23)nn1.
What is the InChIKey of 6-[4-(1H-pyrazol-4-yl)-1H-indazol-7-yl]pyridazin-3-amine?
The InChIKey is OUVYVYZVDGGTJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N7/c15-13-4-3-12(19-20-13)10-2-1-9(8-5-16-17-6-8)11-7-18-21-14(10)11/h1-7H,(H2,15,20)(H,16,17)(H,18,21).
What are the key properties of 6-[4-(1H-pyrazol-4-yl)-1H-indazol-7-yl]pyridazin-3-amine?
6-[4-(1H-pyrazol-4-yl)-1H-indazol-7-yl]pyridazin-3-amine has a molecular weight of 277.29 g/mol, XLogP of 1.99, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(1H-pyrazol-4-yl)-1H-indazol-7-yl]pyridazin-3-amine is sourced from PubChem (CID 156845705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).