About 6-amino-5-chloro-N-hydroxypyridine-3-carboxamide
6-amino-5-chloro-N-hydroxypyridine-3-carboxamide (PubChem CID 130615065) has the molecular formula C6H6ClN3O2
and a molecular weight of 187.59 g/mol. Its IUPAC name is 6-amino-5-chloro-N-hydroxypyridine-3-carboxamide.
Molecular Properties
| Compound Name | 6-amino-5-chloro-N-hydroxypyridine-3-carboxamide |
| PubChem CID | 130615065 |
| Molecular Formula | C6H6ClN3O2 |
| Molecular Weight | 187.59 g/mol |
| Exact Mass | 187.01 |
| IUPAC Name | 6-amino-5-chloro-N-hydroxypyridine-3-carboxamide |
| SMILES | Nc1ncc(C(=O)NO)cc1Cl |
| InChI | InChI=1S/C6H6ClN3O2/c7-4-1-3(6(11)10-12)2-9-5(4)8/h1-2,12H,(H2,8,9)(H,10,11) |
| InChIKey | WZBAFHLGJRIKKW-UHFFFAOYSA-N |
| XLogP | 0.44 |
| TPSA | 88.24 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 12 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 187.59 |
| LogP ≤ 5 | 0.44 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 4 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'hydroxamic_acid', '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-amino-5-chloro-N-hydroxypyridine-3-carboxamide?
The IUPAC name of 6-amino-5-chloro-N-hydroxypyridine-3-carboxamide (CID 130615065) is 6-amino-5-chloro-N-hydroxypyridine-3-carboxamide.
What is the SMILES notation for 6-amino-5-chloro-N-hydroxypyridine-3-carboxamide?
The canonical SMILES for 6-amino-5-chloro-N-hydroxypyridine-3-carboxamide is Nc1ncc(C(=O)NO)cc1Cl.
What is the InChIKey of 6-amino-5-chloro-N-hydroxypyridine-3-carboxamide?
The InChIKey is WZBAFHLGJRIKKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6ClN3O2/c7-4-1-3(6(11)10-12)2-9-5(4)8/h1-2,12H,(H2,8,9)(H,10,11).
What are the key properties of 6-amino-5-chloro-N-hydroxypyridine-3-carboxamide?
6-amino-5-chloro-N-hydroxypyridine-3-carboxamide has a molecular weight of 187.59 g/mol, XLogP of 0.44, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-5-chloro-N-hydroxypyridine-3-carboxamide is sourced from PubChem (CID 130615065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).