About N'-(4-chlorobenzoyl)-2-hydroxybenzohydrazide
N'-(4-chlorobenzoyl)-2-hydroxybenzohydrazide (PubChem CID 2766759) has the molecular formula C14H11ClN2O3
and a molecular weight of 290.71 g/mol. Its IUPAC name is N'-(4-chlorobenzoyl)-2-hydroxybenzohydrazide.
Molecular Properties
| Compound Name | N'-(4-chlorobenzoyl)-2-hydroxybenzohydrazide |
| PubChem CID | 2766759 |
| Molecular Formula | C14H11ClN2O3 |
| Molecular Weight | 290.71 g/mol |
| Exact Mass | 290.05 |
| IUPAC Name | N'-(4-chlorobenzoyl)-2-hydroxybenzohydrazide |
| SMILES | O=C(NNC(=O)c1ccccc1O)c1ccc(Cl)cc1 |
| InChI | InChI=1S/C14H11ClN2O3/c15-10-7-5-9(6-8-10)13(19)16-17-14(20)11-3-1-2-4-12(11)18/h1-8,18H,(H,16,19)(H,17,20) |
| InChIKey | AQVSOQCEJLFIBA-UHFFFAOYSA-N |
| XLogP | 2.12 |
| TPSA | 78.43 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 290.71 |
| LogP ≤ 5 | 2.12 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 3 |
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-chlorobenzoyl)-2-hydroxybenzohydrazide?
The IUPAC name of N'-(4-chlorobenzoyl)-2-hydroxybenzohydrazide (CID 2766759) is N'-(4-chlorobenzoyl)-2-hydroxybenzohydrazide.
What is the SMILES notation for N'-(4-chlorobenzoyl)-2-hydroxybenzohydrazide?
The canonical SMILES for N'-(4-chlorobenzoyl)-2-hydroxybenzohydrazide is O=C(NNC(=O)c1ccccc1O)c1ccc(Cl)cc1.
What is the InChIKey of N'-(4-chlorobenzoyl)-2-hydroxybenzohydrazide?
The InChIKey is AQVSOQCEJLFIBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClN2O3/c15-10-7-5-9(6-8-10)13(19)16-17-14(20)11-3-1-2-4-12(11)18/h1-8,18H,(H,16,19)(H,17,20).
What are the key properties of N'-(4-chlorobenzoyl)-2-hydroxybenzohydrazide?
N'-(4-chlorobenzoyl)-2-hydroxybenzohydrazide has a molecular weight of 290.71 g/mol, XLogP of 2.12, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-chlorobenzoyl)-2-hydroxybenzohydrazide is sourced from PubChem (CID 2766759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).