About N'-[4-(2-methoxyphenyl)phenyl]methanesulfonohydrazide
N'-[4-(2-methoxyphenyl)phenyl]methanesulfonohydrazide (PubChem CID 176904853) has the molecular formula C14H16N2O3S
and a molecular weight of 292.36 g/mol. Its IUPAC name is N'-[4-(2-methoxyphenyl)phenyl]methanesulfonohydrazide.
Molecular Properties
| Compound Name | N'-[4-(2-methoxyphenyl)phenyl]methanesulfonohydrazide |
| PubChem CID | 176904853 |
| Molecular Formula | C14H16N2O3S |
| Molecular Weight | 292.36 g/mol |
| Exact Mass | 292.09 |
| IUPAC Name | N'-[4-(2-methoxyphenyl)phenyl]methanesulfonohydrazide |
| SMILES | COc1ccccc1-c1ccc(NNS(C)(=O)=O)cc1 |
| InChI | InChI=1S/C14H16N2O3S/c1-19-14-6-4-3-5-13(14)11-7-9-12(10-8-11)15-16-20(2,17)18/h3-10,15-16H,1-2H3 |
| InChIKey | WUKWZYLLSZDJEH-UHFFFAOYSA-N |
| XLogP | 2.24 |
| TPSA | 67.43 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 292.36 |
| LogP ≤ 5 | 2.24 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of N'-[4-(2-methoxyphenyl)phenyl]methanesulfonohydrazide?
The IUPAC name of N'-[4-(2-methoxyphenyl)phenyl]methanesulfonohydrazide (CID 176904853) is N'-[4-(2-methoxyphenyl)phenyl]methanesulfonohydrazide.
What is the SMILES notation for N'-[4-(2-methoxyphenyl)phenyl]methanesulfonohydrazide?
The canonical SMILES for N'-[4-(2-methoxyphenyl)phenyl]methanesulfonohydrazide is COc1ccccc1-c1ccc(NNS(C)(=O)=O)cc1.
What is the InChIKey of N'-[4-(2-methoxyphenyl)phenyl]methanesulfonohydrazide?
The InChIKey is WUKWZYLLSZDJEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O3S/c1-19-14-6-4-3-5-13(14)11-7-9-12(10-8-11)15-16-20(2,17)18/h3-10,15-16H,1-2H3.
What are the key properties of N'-[4-(2-methoxyphenyl)phenyl]methanesulfonohydrazide?
N'-[4-(2-methoxyphenyl)phenyl]methanesulfonohydrazide has a molecular weight of 292.36 g/mol, XLogP of 2.24, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[4-(2-methoxyphenyl)phenyl]methanesulfonohydrazide is sourced from PubChem (CID 176904853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).