About 6-chloro-N-propylpyridazin-3-amine
6-chloro-N-propylpyridazin-3-amine (PubChem CID 14517670) has the molecular formula C7H10ClN3
and a molecular weight of 171.63 g/mol. Its IUPAC name is 6-chloro-N-propylpyridazin-3-amine.
Molecular Properties
| Compound Name | 6-chloro-N-propylpyridazin-3-amine |
| PubChem CID | 14517670 |
| Molecular Formula | C7H10ClN3 |
| Molecular Weight | 171.63 g/mol |
| Exact Mass | 171.06 |
| IUPAC Name | 6-chloro-N-propylpyridazin-3-amine |
| SMILES | CCCNc1ccc(Cl)nn1 |
| InChI | InChI=1S/C7H10ClN3/c1-2-5-9-7-4-3-6(8)10-11-7/h3-4H,2,5H2,1H3,(H,9,11) |
| InChIKey | QXJWIXPQOHPVFC-UHFFFAOYSA-N |
| XLogP | 1.95 |
| TPSA | 37.81 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 11 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 171.63 |
| LogP ≤ 5 | 1.95 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 6-chloro-N-propylpyridazin-3-amine?
The IUPAC name of 6-chloro-N-propylpyridazin-3-amine (CID 14517670) is 6-chloro-N-propylpyridazin-3-amine.
What is the SMILES notation for 6-chloro-N-propylpyridazin-3-amine?
The canonical SMILES for 6-chloro-N-propylpyridazin-3-amine is CCCNc1ccc(Cl)nn1.
What is the InChIKey of 6-chloro-N-propylpyridazin-3-amine?
The InChIKey is QXJWIXPQOHPVFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10ClN3/c1-2-5-9-7-4-3-6(8)10-11-7/h3-4H,2,5H2,1H3,(H,9,11).
What are the key properties of 6-chloro-N-propylpyridazin-3-amine?
6-chloro-N-propylpyridazin-3-amine has a molecular weight of 171.63 g/mol, XLogP of 1.95, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-propylpyridazin-3-amine is sourced from PubChem (CID 14517670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).