About 2-chloro-N-(2-hydroxy-1H-indol-5-yl)acetamide
2-chloro-N-(2-hydroxy-1H-indol-5-yl)acetamide (PubChem CID 150237060) has the molecular formula C10H9ClN2O2
and a molecular weight of 224.65 g/mol. Its IUPAC name is 2-chloro-N-(2-hydroxy-1H-indol-5-yl)acetamide.
Molecular Properties
| Compound Name | 2-chloro-N-(2-hydroxy-1H-indol-5-yl)acetamide |
| PubChem CID | 150237060 |
| Molecular Formula | C10H9ClN2O2 |
| Molecular Weight | 224.65 g/mol |
| Exact Mass | 224.04 |
| IUPAC Name | 2-chloro-N-(2-hydroxy-1H-indol-5-yl)acetamide |
| SMILES | O=C(CCl)Nc1ccc2[nH]c(O)cc2c1 |
| InChI | InChI=1S/C10H9ClN2O2/c11-5-10(15)12-7-1-2-8-6(3-7)4-9(14)13-8/h1-4,13-14H,5H2,(H,12,15) |
| InChIKey | FWSSFZWFXBITBN-UHFFFAOYSA-N |
| XLogP | 2.05 |
| TPSA | 65.12 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 224.65 |
| LogP ≤ 5 | 2.05 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'alkyl_halide', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 2-chloro-N-(2-hydroxy-1H-indol-5-yl)acetamide?
The IUPAC name of 2-chloro-N-(2-hydroxy-1H-indol-5-yl)acetamide (CID 150237060) is 2-chloro-N-(2-hydroxy-1H-indol-5-yl)acetamide.
What is the SMILES notation for 2-chloro-N-(2-hydroxy-1H-indol-5-yl)acetamide?
The canonical SMILES for 2-chloro-N-(2-hydroxy-1H-indol-5-yl)acetamide is O=C(CCl)Nc1ccc2[nH]c(O)cc2c1.
What is the InChIKey of 2-chloro-N-(2-hydroxy-1H-indol-5-yl)acetamide?
The InChIKey is FWSSFZWFXBITBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClN2O2/c11-5-10(15)12-7-1-2-8-6(3-7)4-9(14)13-8/h1-4,13-14H,5H2,(H,12,15).
What are the key properties of 2-chloro-N-(2-hydroxy-1H-indol-5-yl)acetamide?
2-chloro-N-(2-hydroxy-1H-indol-5-yl)acetamide has a molecular weight of 224.65 g/mol, XLogP of 2.05, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(2-hydroxy-1H-indol-5-yl)acetamide is sourced from PubChem (CID 150237060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).