About 1-chloro-2-(naphthalen-1-ylmethyl)-1-phenylhydrazine
1-chloro-2-(naphthalen-1-ylmethyl)-1-phenylhydrazine (PubChem CID 175346424) has the molecular formula C17H15ClN2
and a molecular weight of 282.77 g/mol. Its IUPAC name is 1-chloro-2-(naphthalen-1-ylmethyl)-1-phenylhydrazine.
Molecular Properties
| Compound Name | 1-chloro-2-(naphthalen-1-ylmethyl)-1-phenylhydrazine |
| PubChem CID | 175346424 |
| Molecular Formula | C17H15ClN2 |
| Molecular Weight | 282.77 g/mol |
| Exact Mass | 282.09 |
| IUPAC Name | 1-chloro-2-(naphthalen-1-ylmethyl)-1-phenylhydrazine |
| SMILES | ClN(NCc1cccc2ccccc12)c1ccccc1 |
| InChI | InChI=1S/C17H15ClN2/c18-20(16-10-2-1-3-11-16)19-13-15-9-6-8-14-7-4-5-12-17(14)15/h1-12,19H,13H2 |
| InChIKey | JLUDOCHTLJAMEX-UHFFFAOYSA-N |
| XLogP | 4.50 |
| TPSA | 15.27 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 282.77 |
| LogP ≤ 5 | 4.50 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'N-halo', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 1-chloro-2-(naphthalen-1-ylmethyl)-1-phenylhydrazine?
The IUPAC name of 1-chloro-2-(naphthalen-1-ylmethyl)-1-phenylhydrazine (CID 175346424) is 1-chloro-2-(naphthalen-1-ylmethyl)-1-phenylhydrazine.
What is the SMILES notation for 1-chloro-2-(naphthalen-1-ylmethyl)-1-phenylhydrazine?
The canonical SMILES for 1-chloro-2-(naphthalen-1-ylmethyl)-1-phenylhydrazine is ClN(NCc1cccc2ccccc12)c1ccccc1.
What is the InChIKey of 1-chloro-2-(naphthalen-1-ylmethyl)-1-phenylhydrazine?
The InChIKey is JLUDOCHTLJAMEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15ClN2/c18-20(16-10-2-1-3-11-16)19-13-15-9-6-8-14-7-4-5-12-17(14)15/h1-12,19H,13H2.
What are the key properties of 1-chloro-2-(naphthalen-1-ylmethyl)-1-phenylhydrazine?
1-chloro-2-(naphthalen-1-ylmethyl)-1-phenylhydrazine has a molecular weight of 282.77 g/mol, XLogP of 4.50, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-2-(naphthalen-1-ylmethyl)-1-phenylhydrazine is sourced from PubChem (CID 175346424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).