About [1-(4-ethylthiadiazol-5-yl)-5-methylhexyl]hydrazine
[1-(4-ethylthiadiazol-5-yl)-5-methylhexyl]hydrazine (PubChem CID 105331378) has the molecular formula C11H22N4S
and a molecular weight of 242.39 g/mol. Its IUPAC name is [1-(4-ethylthiadiazol-5-yl)-5-methylhexyl]hydrazine.
Molecular Properties
| Compound Name | [1-(4-ethylthiadiazol-5-yl)-5-methylhexyl]hydrazine |
| PubChem CID | 105331378 |
| Molecular Formula | C11H22N4S |
| Molecular Weight | 242.39 g/mol |
| Exact Mass | 242.16 |
| IUPAC Name | [1-(4-ethylthiadiazol-5-yl)-5-methylhexyl]hydrazine |
| SMILES | CCc1nnsc1C(CCCC(C)C)NN |
| InChI | InChI=1S/C11H22N4S/c1-4-9-11(16-15-14-9)10(13-12)7-5-6-8(2)3/h8,10,13H,4-7,12H2,1-3H3 |
| InChIKey | BFWFYXJMHZOEGC-UHFFFAOYSA-N |
| XLogP | 2.43 |
| TPSA | 63.83 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 242.39 |
| LogP ≤ 5 | 2.43 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 5 |
Computed Properties (RDKit)
| Structural Alerts | {'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-(4-ethylthiadiazol-5-yl)-5-methylhexyl]hydrazine?
The IUPAC name of [1-(4-ethylthiadiazol-5-yl)-5-methylhexyl]hydrazine (CID 105331378) is [1-(4-ethylthiadiazol-5-yl)-5-methylhexyl]hydrazine.
What is the SMILES notation for [1-(4-ethylthiadiazol-5-yl)-5-methylhexyl]hydrazine?
The canonical SMILES for [1-(4-ethylthiadiazol-5-yl)-5-methylhexyl]hydrazine is CCc1nnsc1C(CCCC(C)C)NN.
What is the InChIKey of [1-(4-ethylthiadiazol-5-yl)-5-methylhexyl]hydrazine?
The InChIKey is BFWFYXJMHZOEGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N4S/c1-4-9-11(16-15-14-9)10(13-12)7-5-6-8(2)3/h8,10,13H,4-7,12H2,1-3H3.
What are the key properties of [1-(4-ethylthiadiazol-5-yl)-5-methylhexyl]hydrazine?
[1-(4-ethylthiadiazol-5-yl)-5-methylhexyl]hydrazine has a molecular weight of 242.39 g/mol, XLogP of 2.43, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-ethylthiadiazol-5-yl)-5-methylhexyl]hydrazine is sourced from PubChem (CID 105331378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).