About 5-(3-fluorophenyl)pyridazin-4-amine
5-(3-fluorophenyl)pyridazin-4-amine (PubChem CID 117127407) has the molecular formula C10H8FN3
and a molecular weight of 189.19 g/mol. Its IUPAC name is 5-(3-fluorophenyl)pyridazin-4-amine.
Molecular Properties
| Compound Name | 5-(3-fluorophenyl)pyridazin-4-amine |
| PubChem CID | 117127407 |
| Molecular Formula | C10H8FN3 |
| Molecular Weight | 189.19 g/mol |
| Exact Mass | 189.07 |
| IUPAC Name | 5-(3-fluorophenyl)pyridazin-4-amine |
| SMILES | Nc1cnncc1-c1cccc(F)c1 |
| InChI | InChI=1S/C10H8FN3/c11-8-3-1-2-7(4-8)9-5-13-14-6-10(9)12/h1-6H,(H2,12,13) |
| InChIKey | GVLIGLLJVIYKFG-UHFFFAOYSA-N |
| XLogP | 1.86 |
| TPSA | 51.80 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 189.19 |
| LogP ≤ 5 | 1.86 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 5-(3-fluorophenyl)pyridazin-4-amine?
The IUPAC name of 5-(3-fluorophenyl)pyridazin-4-amine (CID 117127407) is 5-(3-fluorophenyl)pyridazin-4-amine.
What is the SMILES notation for 5-(3-fluorophenyl)pyridazin-4-amine?
The canonical SMILES for 5-(3-fluorophenyl)pyridazin-4-amine is Nc1cnncc1-c1cccc(F)c1.
What is the InChIKey of 5-(3-fluorophenyl)pyridazin-4-amine?
The InChIKey is GVLIGLLJVIYKFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8FN3/c11-8-3-1-2-7(4-8)9-5-13-14-6-10(9)12/h1-6H,(H2,12,13).
What are the key properties of 5-(3-fluorophenyl)pyridazin-4-amine?
5-(3-fluorophenyl)pyridazin-4-amine has a molecular weight of 189.19 g/mol, XLogP of 1.86, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-fluorophenyl)pyridazin-4-amine is sourced from PubChem (CID 117127407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).