About [1-benzothiophen-3-yl-(6-methyl-3-pyridinyl)methyl]hydrazine
[1-benzothiophen-3-yl-(6-methyl-3-pyridinyl)methyl]hydrazine (PubChem CID 105305524) has the molecular formula C15H15N3S
and a molecular weight of 269.37 g/mol. Its IUPAC name is [1-benzothiophen-3-yl-(6-methyl-3-pyridinyl)methyl]hydrazine.
Molecular Properties
| Compound Name | [1-benzothiophen-3-yl-(6-methyl-3-pyridinyl)methyl]hydrazine |
| PubChem CID | 105305524 |
| Molecular Formula | C15H15N3S |
| Molecular Weight | 269.37 g/mol |
| Exact Mass | 269.10 |
| IUPAC Name | [1-benzothiophen-3-yl-(6-methyl-3-pyridinyl)methyl]hydrazine |
| SMILES | Cc1ccc(C(NN)c2csc3ccccc23)cn1 |
| InChI | InChI=1S/C15H15N3S/c1-10-6-7-11(8-17-10)15(18-16)13-9-19-14-5-3-2-4-12(13)14/h2-9,15,18H,16H2,1H3 |
| InChIKey | WVIJWCOMSBXWPT-UHFFFAOYSA-N |
| XLogP | 3.16 |
| TPSA | 50.94 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 269.37 |
| LogP ≤ 5 | 3.16 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |
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-benzothiophen-3-yl-(6-methyl-3-pyridinyl)methyl]hydrazine?
The IUPAC name of [1-benzothiophen-3-yl-(6-methyl-3-pyridinyl)methyl]hydrazine (CID 105305524) is [1-benzothiophen-3-yl-(6-methyl-3-pyridinyl)methyl]hydrazine.
What is the SMILES notation for [1-benzothiophen-3-yl-(6-methyl-3-pyridinyl)methyl]hydrazine?
The canonical SMILES for [1-benzothiophen-3-yl-(6-methyl-3-pyridinyl)methyl]hydrazine is Cc1ccc(C(NN)c2csc3ccccc23)cn1.
What is the InChIKey of [1-benzothiophen-3-yl-(6-methyl-3-pyridinyl)methyl]hydrazine?
The InChIKey is WVIJWCOMSBXWPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3S/c1-10-6-7-11(8-17-10)15(18-16)13-9-19-14-5-3-2-4-12(13)14/h2-9,15,18H,16H2,1H3.
What are the key properties of [1-benzothiophen-3-yl-(6-methyl-3-pyridinyl)methyl]hydrazine?
[1-benzothiophen-3-yl-(6-methyl-3-pyridinyl)methyl]hydrazine has a molecular weight of 269.37 g/mol, XLogP of 3.16, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-benzothiophen-3-yl-(6-methyl-3-pyridinyl)methyl]hydrazine is sourced from PubChem (CID 105305524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).