About N'-[2-(4-fluorophenyl)cyclopropanecarbonyl]-2-hydroxybenzohydrazide
N'-[2-(4-fluorophenyl)cyclopropanecarbonyl]-2-hydroxybenzohydrazide (PubChem CID 51292428) has the molecular formula C17H15FN2O3
and a molecular weight of 314.32 g/mol. Its IUPAC name is N'-[2-(4-fluorophenyl)cyclopropanecarbonyl]-2-hydroxybenzohydrazide.
Molecular Properties
| Compound Name | N'-[2-(4-fluorophenyl)cyclopropanecarbonyl]-2-hydroxybenzohydrazide |
| PubChem CID | 51292428 |
| Molecular Formula | C17H15FN2O3 |
| Molecular Weight | 314.32 g/mol |
| Exact Mass | 314.11 |
| IUPAC Name | N'-[2-(4-fluorophenyl)cyclopropanecarbonyl]-2-hydroxybenzohydrazide |
| SMILES | O=C(NNC(=O)C1CC1c1ccc(F)cc1)c1ccccc1O |
| InChI | InChI=1S/C17H15FN2O3/c18-11-7-5-10(6-8-11)13-9-14(13)17(23)20-19-16(22)12-3-1-2-4-15(12)21/h1-8,13-14,21H,9H2,(H,19,22)(H,20,23) |
| InChIKey | UEUNXYHPTLPEPV-UHFFFAOYSA-N |
| XLogP | 2.10 |
| TPSA | 78.43 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 23 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 314.32 |
| LogP ≤ 5 | 2.10 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
|---|
Analyze N'-[2-(4-fluorophenyl)cyclopropanecarbonyl]-2-hydroxybenzohydrazide 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 N'-[2-(4-fluorophenyl)cyclopropanecarbonyl]-2-hydroxybenzohydrazide?
The IUPAC name of N'-[2-(4-fluorophenyl)cyclopropanecarbonyl]-2-hydroxybenzohydrazide (CID 51292428) is N'-[2-(4-fluorophenyl)cyclopropanecarbonyl]-2-hydroxybenzohydrazide.
What is the SMILES notation for N'-[2-(4-fluorophenyl)cyclopropanecarbonyl]-2-hydroxybenzohydrazide?
The canonical SMILES for N'-[2-(4-fluorophenyl)cyclopropanecarbonyl]-2-hydroxybenzohydrazide is O=C(NNC(=O)C1CC1c1ccc(F)cc1)c1ccccc1O.
What is the InChIKey of N'-[2-(4-fluorophenyl)cyclopropanecarbonyl]-2-hydroxybenzohydrazide?
The InChIKey is UEUNXYHPTLPEPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15FN2O3/c18-11-7-5-10(6-8-11)13-9-14(13)17(23)20-19-16(22)12-3-1-2-4-15(12)21/h1-8,13-14,21H,9H2,(H,19,22)(H,20,23).
What are the key properties of N'-[2-(4-fluorophenyl)cyclopropanecarbonyl]-2-hydroxybenzohydrazide?
N'-[2-(4-fluorophenyl)cyclopropanecarbonyl]-2-hydroxybenzohydrazide has a molecular weight of 314.32 g/mol, XLogP of 2.10, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(4-fluorophenyl)cyclopropanecarbonyl]-2-hydroxybenzohydrazide is sourced from PubChem (CID 51292428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).