About 2-hydroxy-3-pyrazin-2-ylprop-2-enamide
2-hydroxy-3-pyrazin-2-ylprop-2-enamide (PubChem CID 149253820) has the molecular formula C7H7N3O2
and a molecular weight of 165.15 g/mol. Its IUPAC name is 2-hydroxy-3-pyrazin-2-ylprop-2-enamide.
Molecular Properties
| Compound Name | 2-hydroxy-3-pyrazin-2-ylprop-2-enamide |
| PubChem CID | 149253820 |
| Molecular Formula | C7H7N3O2 |
| Molecular Weight | 165.15 g/mol |
| Exact Mass | 165.05 |
| IUPAC Name | 2-hydroxy-3-pyrazin-2-ylprop-2-enamide |
| SMILES | NC(=O)C(O)=Cc1cnccn1 |
| InChI | InChI=1S/C7H7N3O2/c8-7(12)6(11)3-5-4-9-1-2-10-5/h1-4,11H,(H2,8,12) |
| InChIKey | HUKHGAPPHSYESC-UHFFFAOYSA-N |
| XLogP | -0.14 |
| TPSA | 89.10 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 12 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 165.15 |
| LogP ≤ 5 | -0.14 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 2-hydroxy-3-pyrazin-2-ylprop-2-enamide?
The IUPAC name of 2-hydroxy-3-pyrazin-2-ylprop-2-enamide (CID 149253820) is 2-hydroxy-3-pyrazin-2-ylprop-2-enamide.
What is the SMILES notation for 2-hydroxy-3-pyrazin-2-ylprop-2-enamide?
The canonical SMILES for 2-hydroxy-3-pyrazin-2-ylprop-2-enamide is NC(=O)C(O)=Cc1cnccn1.
What is the InChIKey of 2-hydroxy-3-pyrazin-2-ylprop-2-enamide?
The InChIKey is HUKHGAPPHSYESC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N3O2/c8-7(12)6(11)3-5-4-9-1-2-10-5/h1-4,11H,(H2,8,12).
What are the key properties of 2-hydroxy-3-pyrazin-2-ylprop-2-enamide?
2-hydroxy-3-pyrazin-2-ylprop-2-enamide has a molecular weight of 165.15 g/mol, XLogP of -0.14, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-3-pyrazin-2-ylprop-2-enamide is sourced from PubChem (CID 149253820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).