About N'-(4-phenylbenzoyl)naphthalene-1-carbohydrazide
N'-(4-phenylbenzoyl)naphthalene-1-carbohydrazide (PubChem CID 3127351) has the molecular formula C24H18N2O2
and a molecular weight of 366.42 g/mol. Its IUPAC name is N'-(4-phenylbenzoyl)naphthalene-1-carbohydrazide.
Molecular Properties
| Compound Name | N'-(4-phenylbenzoyl)naphthalene-1-carbohydrazide |
| PubChem CID | 3127351 |
| Molecular Formula | C24H18N2O2 |
| Molecular Weight | 366.42 g/mol |
| Exact Mass | 366.14 |
| IUPAC Name | N'-(4-phenylbenzoyl)naphthalene-1-carbohydrazide |
| SMILES | O=C(NNC(=O)c1cccc2ccccc12)c1ccc(-c2ccccc2)cc1 |
| InChI | InChI=1S/C24H18N2O2/c27-23(20-15-13-18(14-16-20)17-7-2-1-3-8-17)25-26-24(28)22-12-6-10-19-9-4-5-11-21(19)22/h1-16H,(H,25,27)(H,26,28) |
| InChIKey | MHAKZZONPKXZMU-UHFFFAOYSA-N |
| XLogP | 4.58 |
| TPSA | 58.20 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 28 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 366.42 |
| LogP ≤ 5 | 4.58 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
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-phenylbenzoyl)naphthalene-1-carbohydrazide?
The IUPAC name of N'-(4-phenylbenzoyl)naphthalene-1-carbohydrazide (CID 3127351) is N'-(4-phenylbenzoyl)naphthalene-1-carbohydrazide.
What is the SMILES notation for N'-(4-phenylbenzoyl)naphthalene-1-carbohydrazide?
The canonical SMILES for N'-(4-phenylbenzoyl)naphthalene-1-carbohydrazide is O=C(NNC(=O)c1cccc2ccccc12)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of N'-(4-phenylbenzoyl)naphthalene-1-carbohydrazide?
The InChIKey is MHAKZZONPKXZMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18N2O2/c27-23(20-15-13-18(14-16-20)17-7-2-1-3-8-17)25-26-24(28)22-12-6-10-19-9-4-5-11-21(19)22/h1-16H,(H,25,27)(H,26,28).
What are the key properties of N'-(4-phenylbenzoyl)naphthalene-1-carbohydrazide?
N'-(4-phenylbenzoyl)naphthalene-1-carbohydrazide has a molecular weight of 366.42 g/mol, XLogP of 4.58, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-phenylbenzoyl)naphthalene-1-carbohydrazide is sourced from PubChem (CID 3127351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).