About 1-(thiadiazol-4-yl)octylhydrazine
1-(thiadiazol-4-yl)octylhydrazine (PubChem CID 105293500) has the molecular formula C10H20N4S
and a molecular weight of 228.36 g/mol. Its IUPAC name is 1-(thiadiazol-4-yl)octylhydrazine.
Molecular Properties
| Compound Name | 1-(thiadiazol-4-yl)octylhydrazine |
| PubChem CID | 105293500 |
| Molecular Formula | C10H20N4S |
| Molecular Weight | 228.36 g/mol |
| Exact Mass | 228.14 |
| IUPAC Name | 1-(thiadiazol-4-yl)octylhydrazine |
| SMILES | CCCCCCCC(NN)c1csnn1 |
| InChI | InChI=1S/C10H20N4S/c1-2-3-4-5-6-7-9(12-11)10-8-15-14-13-10/h8-9,12H,2-7,11H2,1H3 |
| InChIKey | QXHBMRCPPONIJP-UHFFFAOYSA-N |
| XLogP | 2.40 |
| TPSA | 63.83 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 228.36 |
| LogP ≤ 5 | 2.40 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 5 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 1-(thiadiazol-4-yl)octylhydrazine?
The IUPAC name of 1-(thiadiazol-4-yl)octylhydrazine (CID 105293500) is 1-(thiadiazol-4-yl)octylhydrazine.
What is the SMILES notation for 1-(thiadiazol-4-yl)octylhydrazine?
The canonical SMILES for 1-(thiadiazol-4-yl)octylhydrazine is CCCCCCCC(NN)c1csnn1.
What is the InChIKey of 1-(thiadiazol-4-yl)octylhydrazine?
The InChIKey is QXHBMRCPPONIJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N4S/c1-2-3-4-5-6-7-9(12-11)10-8-15-14-13-10/h8-9,12H,2-7,11H2,1H3.
What are the key properties of 1-(thiadiazol-4-yl)octylhydrazine?
1-(thiadiazol-4-yl)octylhydrazine has a molecular weight of 228.36 g/mol, XLogP of 2.40, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(thiadiazol-4-yl)octylhydrazine is sourced from PubChem (CID 105293500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).