About [2-methoxy-1-(3-methyl-4-pyridinyl)ethyl]hydrazine
[2-methoxy-1-(3-methyl-4-pyridinyl)ethyl]hydrazine (PubChem CID 105261958) has the molecular formula C9H15N3O
and a molecular weight of 181.24 g/mol. Its IUPAC name is [2-methoxy-1-(3-methyl-4-pyridinyl)ethyl]hydrazine.
Molecular Properties
| Compound Name | [2-methoxy-1-(3-methyl-4-pyridinyl)ethyl]hydrazine |
| PubChem CID | 105261958 |
| Molecular Formula | C9H15N3O |
| Molecular Weight | 181.24 g/mol |
| Exact Mass | 181.12 |
| IUPAC Name | [2-methoxy-1-(3-methyl-4-pyridinyl)ethyl]hydrazine |
| SMILES | COCC(NN)c1ccncc1C |
| InChI | InChI=1S/C9H15N3O/c1-7-5-11-4-3-8(7)9(12-10)6-13-2/h3-5,9,12H,6,10H2,1-2H3 |
| InChIKey | KQCOGQUYVIBFPA-UHFFFAOYSA-N |
| XLogP | 0.54 |
| TPSA | 60.17 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 181.24 |
| LogP ≤ 5 | 0.54 |
| 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 [2-methoxy-1-(3-methyl-4-pyridinyl)ethyl]hydrazine?
The IUPAC name of [2-methoxy-1-(3-methyl-4-pyridinyl)ethyl]hydrazine (CID 105261958) is [2-methoxy-1-(3-methyl-4-pyridinyl)ethyl]hydrazine.
What is the SMILES notation for [2-methoxy-1-(3-methyl-4-pyridinyl)ethyl]hydrazine?
The canonical SMILES for [2-methoxy-1-(3-methyl-4-pyridinyl)ethyl]hydrazine is COCC(NN)c1ccncc1C.
What is the InChIKey of [2-methoxy-1-(3-methyl-4-pyridinyl)ethyl]hydrazine?
The InChIKey is KQCOGQUYVIBFPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O/c1-7-5-11-4-3-8(7)9(12-10)6-13-2/h3-5,9,12H,6,10H2,1-2H3.
What are the key properties of [2-methoxy-1-(3-methyl-4-pyridinyl)ethyl]hydrazine?
[2-methoxy-1-(3-methyl-4-pyridinyl)ethyl]hydrazine has a molecular weight of 181.24 g/mol, XLogP of 0.54, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-methoxy-1-(3-methyl-4-pyridinyl)ethyl]hydrazine is sourced from PubChem (CID 105261958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).