About 1-(5-chloro-2-fluorophenyl)-2-hydrazinylethanol
1-(5-chloro-2-fluorophenyl)-2-hydrazinylethanol (PubChem CID 82649992) has the molecular formula C8H10ClFN2O
and a molecular weight of 204.63 g/mol. Its IUPAC name is 1-(5-chloro-2-fluorophenyl)-2-hydrazinylethanol.
Molecular Properties
| Compound Name | 1-(5-chloro-2-fluorophenyl)-2-hydrazinylethanol |
| PubChem CID | 82649992 |
| Molecular Formula | C8H10ClFN2O |
| Molecular Weight | 204.63 g/mol |
| Exact Mass | 204.05 |
| IUPAC Name | 1-(5-chloro-2-fluorophenyl)-2-hydrazinylethanol |
| SMILES | NNCC(O)c1cc(Cl)ccc1F |
| InChI | InChI=1S/C8H10ClFN2O/c9-5-1-2-7(10)6(3-5)8(13)4-12-11/h1-3,8,12-13H,4,11H2 |
| InChIKey | KUJINGHDTVNKQE-UHFFFAOYSA-N |
| XLogP | 0.98 |
| TPSA | 58.28 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 204.63 |
| LogP ≤ 5 | 0.98 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 3 |
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 1-(5-chloro-2-fluorophenyl)-2-hydrazinylethanol?
The IUPAC name of 1-(5-chloro-2-fluorophenyl)-2-hydrazinylethanol (CID 82649992) is 1-(5-chloro-2-fluorophenyl)-2-hydrazinylethanol.
What is the SMILES notation for 1-(5-chloro-2-fluorophenyl)-2-hydrazinylethanol?
The canonical SMILES for 1-(5-chloro-2-fluorophenyl)-2-hydrazinylethanol is NNCC(O)c1cc(Cl)ccc1F.
What is the InChIKey of 1-(5-chloro-2-fluorophenyl)-2-hydrazinylethanol?
The InChIKey is KUJINGHDTVNKQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10ClFN2O/c9-5-1-2-7(10)6(3-5)8(13)4-12-11/h1-3,8,12-13H,4,11H2.
What are the key properties of 1-(5-chloro-2-fluorophenyl)-2-hydrazinylethanol?
1-(5-chloro-2-fluorophenyl)-2-hydrazinylethanol has a molecular weight of 204.63 g/mol, XLogP of 0.98, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-chloro-2-fluorophenyl)-2-hydrazinylethanol is sourced from PubChem (CID 82649992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).