About 1-(4-hydrazinylphenyl)sulfonylpyrrolidin-3-ol
1-(4-hydrazinylphenyl)sulfonylpyrrolidin-3-ol (PubChem CID 62941759) has the molecular formula C10H15N3O3S
and a molecular weight of 257.31 g/mol. Its IUPAC name is 1-(4-hydrazinylphenyl)sulfonylpyrrolidin-3-ol.
Molecular Properties
| Compound Name | 1-(4-hydrazinylphenyl)sulfonylpyrrolidin-3-ol |
| PubChem CID | 62941759 |
| Molecular Formula | C10H15N3O3S |
| Molecular Weight | 257.31 g/mol |
| Exact Mass | 257.08 |
| IUPAC Name | 1-(4-hydrazinylphenyl)sulfonylpyrrolidin-3-ol |
| SMILES | NNc1ccc(S(=O)(=O)N2CCC(O)C2)cc1 |
| InChI | InChI=1S/C10H15N3O3S/c11-12-8-1-3-10(4-2-8)17(15,16)13-6-5-9(14)7-13/h1-4,9,12,14H,5-7,11H2 |
| InChIKey | UIFKOLMKBKMMEM-UHFFFAOYSA-N |
| XLogP | -0.27 |
| TPSA | 95.66 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 257.31 |
| LogP ≤ 5 | -0.27 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 5 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
|---|
Analyze 1-(4-hydrazinylphenyl)sulfonylpyrrolidin-3-ol 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 1-(4-hydrazinylphenyl)sulfonylpyrrolidin-3-ol?
The IUPAC name of 1-(4-hydrazinylphenyl)sulfonylpyrrolidin-3-ol (CID 62941759) is 1-(4-hydrazinylphenyl)sulfonylpyrrolidin-3-ol.
What is the SMILES notation for 1-(4-hydrazinylphenyl)sulfonylpyrrolidin-3-ol?
The canonical SMILES for 1-(4-hydrazinylphenyl)sulfonylpyrrolidin-3-ol is NNc1ccc(S(=O)(=O)N2CCC(O)C2)cc1.
What is the InChIKey of 1-(4-hydrazinylphenyl)sulfonylpyrrolidin-3-ol?
The InChIKey is UIFKOLMKBKMMEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O3S/c11-12-8-1-3-10(4-2-8)17(15,16)13-6-5-9(14)7-13/h1-4,9,12,14H,5-7,11H2.
What are the key properties of 1-(4-hydrazinylphenyl)sulfonylpyrrolidin-3-ol?
1-(4-hydrazinylphenyl)sulfonylpyrrolidin-3-ol has a molecular weight of 257.31 g/mol, XLogP of -0.27, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-hydrazinylphenyl)sulfonylpyrrolidin-3-ol is sourced from PubChem (CID 62941759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).