About [1-benzothiophen-3-yl(cyclohexyl)methyl]hydrazine
[1-benzothiophen-3-yl(cyclohexyl)methyl]hydrazine (PubChem CID 105282068) has the molecular formula C15H20N2S
and a molecular weight of 260.41 g/mol. Its IUPAC name is [1-benzothiophen-3-yl(cyclohexyl)methyl]hydrazine.
Molecular Properties
| Compound Name | [1-benzothiophen-3-yl(cyclohexyl)methyl]hydrazine |
| PubChem CID | 105282068 |
| Molecular Formula | C15H20N2S |
| Molecular Weight | 260.41 g/mol |
| Exact Mass | 260.13 |
| IUPAC Name | [1-benzothiophen-3-yl(cyclohexyl)methyl]hydrazine |
| SMILES | NNC(c1csc2ccccc12)C1CCCCC1 |
| InChI | InChI=1S/C15H20N2S/c16-17-15(11-6-2-1-3-7-11)13-10-18-14-9-5-4-8-12(13)14/h4-5,8-11,15,17H,1-3,6-7,16H2 |
| InChIKey | DJGQVUWOQVKKQN-UHFFFAOYSA-N |
| XLogP | 3.99 |
| TPSA | 38.05 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 260.41 |
| LogP ≤ 5 | 3.99 |
| 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'} |
|---|
Analyze [1-benzothiophen-3-yl(cyclohexyl)methyl]hydrazine with MolForge
Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.
Launch Full Analysis
Frequently Asked Questions
What is the IUPAC name of [1-benzothiophen-3-yl(cyclohexyl)methyl]hydrazine?
The IUPAC name of [1-benzothiophen-3-yl(cyclohexyl)methyl]hydrazine (CID 105282068) is [1-benzothiophen-3-yl(cyclohexyl)methyl]hydrazine.
What is the SMILES notation for [1-benzothiophen-3-yl(cyclohexyl)methyl]hydrazine?
The canonical SMILES for [1-benzothiophen-3-yl(cyclohexyl)methyl]hydrazine is NNC(c1csc2ccccc12)C1CCCCC1.
What is the InChIKey of [1-benzothiophen-3-yl(cyclohexyl)methyl]hydrazine?
The InChIKey is DJGQVUWOQVKKQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2S/c16-17-15(11-6-2-1-3-7-11)13-10-18-14-9-5-4-8-12(13)14/h4-5,8-11,15,17H,1-3,6-7,16H2.
What are the key properties of [1-benzothiophen-3-yl(cyclohexyl)methyl]hydrazine?
[1-benzothiophen-3-yl(cyclohexyl)methyl]hydrazine has a molecular weight of 260.41 g/mol, XLogP of 3.99, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-benzothiophen-3-yl(cyclohexyl)methyl]hydrazine is sourced from PubChem (CID 105282068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).