About 6-hydrazinyl-N-(4-methoxy-3-methylphenyl)pyrazin-2-amine
6-hydrazinyl-N-(4-methoxy-3-methylphenyl)pyrazin-2-amine (PubChem CID 80897203) has the molecular formula C12H15N5O
and a molecular weight of 245.29 g/mol. Its IUPAC name is 6-hydrazinyl-N-(4-methoxy-3-methylphenyl)pyrazin-2-amine.
Molecular Properties
| Compound Name | 6-hydrazinyl-N-(4-methoxy-3-methylphenyl)pyrazin-2-amine |
| PubChem CID | 80897203 |
| Molecular Formula | C12H15N5O |
| Molecular Weight | 245.29 g/mol |
| Exact Mass | 245.13 |
| IUPAC Name | 6-hydrazinyl-N-(4-methoxy-3-methylphenyl)pyrazin-2-amine |
| SMILES | COc1ccc(Nc2cncc(NN)n2)cc1C |
| InChI | InChI=1S/C12H15N5O/c1-8-5-9(3-4-10(8)18-2)15-11-6-14-7-12(16-11)17-13/h3-7H,13H2,1-2H3,(H2,15,16,17) |
| InChIKey | ODQAPZOUVJOENH-UHFFFAOYSA-N |
| XLogP | 1.82 |
| TPSA | 85.09 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 245.29 |
| LogP ≤ 5 | 1.82 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 6 |
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 6-hydrazinyl-N-(4-methoxy-3-methylphenyl)pyrazin-2-amine?
The IUPAC name of 6-hydrazinyl-N-(4-methoxy-3-methylphenyl)pyrazin-2-amine (CID 80897203) is 6-hydrazinyl-N-(4-methoxy-3-methylphenyl)pyrazin-2-amine.
What is the SMILES notation for 6-hydrazinyl-N-(4-methoxy-3-methylphenyl)pyrazin-2-amine?
The canonical SMILES for 6-hydrazinyl-N-(4-methoxy-3-methylphenyl)pyrazin-2-amine is COc1ccc(Nc2cncc(NN)n2)cc1C.
What is the InChIKey of 6-hydrazinyl-N-(4-methoxy-3-methylphenyl)pyrazin-2-amine?
The InChIKey is ODQAPZOUVJOENH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N5O/c1-8-5-9(3-4-10(8)18-2)15-11-6-14-7-12(16-11)17-13/h3-7H,13H2,1-2H3,(H2,15,16,17).
What are the key properties of 6-hydrazinyl-N-(4-methoxy-3-methylphenyl)pyrazin-2-amine?
6-hydrazinyl-N-(4-methoxy-3-methylphenyl)pyrazin-2-amine has a molecular weight of 245.29 g/mol, XLogP of 1.82, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-N-(4-methoxy-3-methylphenyl)pyrazin-2-amine is sourced from PubChem (CID 80897203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).