About 1-(3-methylthiophen-2-yl)pentylhydrazine
1-(3-methylthiophen-2-yl)pentylhydrazine (PubChem CID 105245717) has the molecular formula C10H18N2S
and a molecular weight of 198.33 g/mol. Its IUPAC name is 1-(3-methylthiophen-2-yl)pentylhydrazine.
Molecular Properties
| Compound Name | 1-(3-methylthiophen-2-yl)pentylhydrazine |
| PubChem CID | 105245717 |
| Molecular Formula | C10H18N2S |
| Molecular Weight | 198.33 g/mol |
| Exact Mass | 198.12 |
| IUPAC Name | 1-(3-methylthiophen-2-yl)pentylhydrazine |
| SMILES | CCCCC(NN)c1sccc1C |
| InChI | InChI=1S/C10H18N2S/c1-3-4-5-9(12-11)10-8(2)6-7-13-10/h6-7,9,12H,3-5,11H2,1-2H3 |
| InChIKey | LWXYOCZJWLPHAJ-UHFFFAOYSA-N |
| XLogP | 2.75 |
| TPSA | 38.05 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 198.33 |
| LogP ≤ 5 | 2.75 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
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-(3-methylthiophen-2-yl)pentylhydrazine?
The IUPAC name of 1-(3-methylthiophen-2-yl)pentylhydrazine (CID 105245717) is 1-(3-methylthiophen-2-yl)pentylhydrazine.
What is the SMILES notation for 1-(3-methylthiophen-2-yl)pentylhydrazine?
The canonical SMILES for 1-(3-methylthiophen-2-yl)pentylhydrazine is CCCCC(NN)c1sccc1C.
What is the InChIKey of 1-(3-methylthiophen-2-yl)pentylhydrazine?
The InChIKey is LWXYOCZJWLPHAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2S/c1-3-4-5-9(12-11)10-8(2)6-7-13-10/h6-7,9,12H,3-5,11H2,1-2H3.
What are the key properties of 1-(3-methylthiophen-2-yl)pentylhydrazine?
1-(3-methylthiophen-2-yl)pentylhydrazine has a molecular weight of 198.33 g/mol, XLogP of 2.75, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methylthiophen-2-yl)pentylhydrazine is sourced from PubChem (CID 105245717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).