About [(3-methoxy-4-pyridinyl)-(3-methylthiophen-2-yl)methyl]hydrazine
[(3-methoxy-4-pyridinyl)-(3-methylthiophen-2-yl)methyl]hydrazine (PubChem CID 105322474) has the molecular formula C12H15N3OS
and a molecular weight of 249.34 g/mol. Its IUPAC name is [(3-methoxy-4-pyridinyl)-(3-methylthiophen-2-yl)methyl]hydrazine.
Molecular Properties
| Compound Name | [(3-methoxy-4-pyridinyl)-(3-methylthiophen-2-yl)methyl]hydrazine |
| PubChem CID | 105322474 |
| Molecular Formula | C12H15N3OS |
| Molecular Weight | 249.34 g/mol |
| Exact Mass | 249.09 |
| IUPAC Name | [(3-methoxy-4-pyridinyl)-(3-methylthiophen-2-yl)methyl]hydrazine |
| SMILES | COc1cnccc1C(NN)c1sccc1C |
| InChI | InChI=1S/C12H15N3OS/c1-8-4-6-17-12(8)11(15-13)9-3-5-14-7-10(9)16-2/h3-7,11,15H,13H2,1-2H3 |
| InChIKey | OAFFGQAGMCGTPK-UHFFFAOYSA-N |
| XLogP | 2.01 |
| TPSA | 60.17 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 249.34 |
| LogP ≤ 5 | 2.01 |
| 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 [(3-methoxy-4-pyridinyl)-(3-methylthiophen-2-yl)methyl]hydrazine?
The IUPAC name of [(3-methoxy-4-pyridinyl)-(3-methylthiophen-2-yl)methyl]hydrazine (CID 105322474) is [(3-methoxy-4-pyridinyl)-(3-methylthiophen-2-yl)methyl]hydrazine.
What is the SMILES notation for [(3-methoxy-4-pyridinyl)-(3-methylthiophen-2-yl)methyl]hydrazine?
The canonical SMILES for [(3-methoxy-4-pyridinyl)-(3-methylthiophen-2-yl)methyl]hydrazine is COc1cnccc1C(NN)c1sccc1C.
What is the InChIKey of [(3-methoxy-4-pyridinyl)-(3-methylthiophen-2-yl)methyl]hydrazine?
The InChIKey is OAFFGQAGMCGTPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3OS/c1-8-4-6-17-12(8)11(15-13)9-3-5-14-7-10(9)16-2/h3-7,11,15H,13H2,1-2H3.
What are the key properties of [(3-methoxy-4-pyridinyl)-(3-methylthiophen-2-yl)methyl]hydrazine?
[(3-methoxy-4-pyridinyl)-(3-methylthiophen-2-yl)methyl]hydrazine has a molecular weight of 249.34 g/mol, XLogP of 2.01, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-methoxy-4-pyridinyl)-(3-methylthiophen-2-yl)methyl]hydrazine is sourced from PubChem (CID 105322474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).