About [cyclobutyl-(4-methylthiadiazol-5-yl)methyl]hydrazine
[cyclobutyl-(4-methylthiadiazol-5-yl)methyl]hydrazine (PubChem CID 105340044) has the molecular formula C8H14N4S
and a molecular weight of 198.29 g/mol. Its IUPAC name is [cyclobutyl-(4-methylthiadiazol-5-yl)methyl]hydrazine.
Molecular Properties
| Compound Name | [cyclobutyl-(4-methylthiadiazol-5-yl)methyl]hydrazine |
| PubChem CID | 105340044 |
| Molecular Formula | C8H14N4S |
| Molecular Weight | 198.29 g/mol |
| Exact Mass | 198.09 |
| IUPAC Name | [cyclobutyl-(4-methylthiadiazol-5-yl)methyl]hydrazine |
| SMILES | Cc1nnsc1C(NN)C1CCC1 |
| InChI | InChI=1S/C8H14N4S/c1-5-8(13-12-11-5)7(10-9)6-3-2-4-6/h6-7,10H,2-4,9H2,1H3 |
| InChIKey | DJZLQKQOUAWJRK-UHFFFAOYSA-N |
| XLogP | 1.15 |
| TPSA | 63.83 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 198.29 |
| LogP ≤ 5 | 1.15 |
| 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 [cyclobutyl-(4-methylthiadiazol-5-yl)methyl]hydrazine?
The IUPAC name of [cyclobutyl-(4-methylthiadiazol-5-yl)methyl]hydrazine (CID 105340044) is [cyclobutyl-(4-methylthiadiazol-5-yl)methyl]hydrazine.
What is the SMILES notation for [cyclobutyl-(4-methylthiadiazol-5-yl)methyl]hydrazine?
The canonical SMILES for [cyclobutyl-(4-methylthiadiazol-5-yl)methyl]hydrazine is Cc1nnsc1C(NN)C1CCC1.
What is the InChIKey of [cyclobutyl-(4-methylthiadiazol-5-yl)methyl]hydrazine?
The InChIKey is DJZLQKQOUAWJRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4S/c1-5-8(13-12-11-5)7(10-9)6-3-2-4-6/h6-7,10H,2-4,9H2,1H3.
What are the key properties of [cyclobutyl-(4-methylthiadiazol-5-yl)methyl]hydrazine?
[cyclobutyl-(4-methylthiadiazol-5-yl)methyl]hydrazine has a molecular weight of 198.29 g/mol, XLogP of 1.15, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [cyclobutyl-(4-methylthiadiazol-5-yl)methyl]hydrazine is sourced from PubChem (CID 105340044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).