About N-(4-bromophenyl)-5-hydroxypyridine-3-carboxamide
N-(4-bromophenyl)-5-hydroxypyridine-3-carboxamide (PubChem CID 63851687) has the molecular formula C12H9BrN2O2
and a molecular weight of 293.12 g/mol. Its IUPAC name is N-(4-bromophenyl)-5-hydroxypyridine-3-carboxamide.
Molecular Properties
| Compound Name | N-(4-bromophenyl)-5-hydroxypyridine-3-carboxamide |
| PubChem CID | 63851687 |
| Molecular Formula | C12H9BrN2O2 |
| Molecular Weight | 293.12 g/mol |
| Exact Mass | 291.98 |
| IUPAC Name | N-(4-bromophenyl)-5-hydroxypyridine-3-carboxamide |
| SMILES | O=C(Nc1ccc(Br)cc1)c1cncc(O)c1 |
| InChI | InChI=1S/C12H9BrN2O2/c13-9-1-3-10(4-2-9)15-12(17)8-5-11(16)7-14-6-8/h1-7,16H,(H,15,17) |
| InChIKey | DLPXQQAVTGXXMU-UHFFFAOYSA-N |
| XLogP | 2.80 |
| TPSA | 62.22 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 293.12 |
| LogP ≤ 5 | 2.80 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
Analyze N-(4-bromophenyl)-5-hydroxypyridine-3-carboxamide with MolForge
Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.
Launch Full Analysis
Frequently Asked Questions
What is the IUPAC name of N-(4-bromophenyl)-5-hydroxypyridine-3-carboxamide?
The IUPAC name of N-(4-bromophenyl)-5-hydroxypyridine-3-carboxamide (CID 63851687) is N-(4-bromophenyl)-5-hydroxypyridine-3-carboxamide.
What is the SMILES notation for N-(4-bromophenyl)-5-hydroxypyridine-3-carboxamide?
The canonical SMILES for N-(4-bromophenyl)-5-hydroxypyridine-3-carboxamide is O=C(Nc1ccc(Br)cc1)c1cncc(O)c1.
What is the InChIKey of N-(4-bromophenyl)-5-hydroxypyridine-3-carboxamide?
The InChIKey is DLPXQQAVTGXXMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9BrN2O2/c13-9-1-3-10(4-2-9)15-12(17)8-5-11(16)7-14-6-8/h1-7,16H,(H,15,17).
What are the key properties of N-(4-bromophenyl)-5-hydroxypyridine-3-carboxamide?
N-(4-bromophenyl)-5-hydroxypyridine-3-carboxamide has a molecular weight of 293.12 g/mol, XLogP of 2.80, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromophenyl)-5-hydroxypyridine-3-carboxamide is sourced from PubChem (CID 63851687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).