About [(4-fluoro-3-methylphenyl)-naphthalen-2-ylmethyl]hydrazine
[(4-fluoro-3-methylphenyl)-naphthalen-2-ylmethyl]hydrazine (PubChem CID 105204047) has the molecular formula C18H17FN2
and a molecular weight of 280.35 g/mol. Its IUPAC name is [(4-fluoro-3-methylphenyl)-naphthalen-2-ylmethyl]hydrazine.
Molecular Properties
| Compound Name | [(4-fluoro-3-methylphenyl)-naphthalen-2-ylmethyl]hydrazine |
| PubChem CID | 105204047 |
| Molecular Formula | C18H17FN2 |
| Molecular Weight | 280.35 g/mol |
| Exact Mass | 280.14 |
| IUPAC Name | [(4-fluoro-3-methylphenyl)-naphthalen-2-ylmethyl]hydrazine |
| SMILES | Cc1cc(C(NN)c2ccc3ccccc3c2)ccc1F |
| InChI | InChI=1S/C18H17FN2/c1-12-10-15(8-9-17(12)19)18(21-20)16-7-6-13-4-2-3-5-14(13)11-16/h2-11,18,21H,20H2,1H3 |
| InChIKey | LIRPKDXWXLGJDI-UHFFFAOYSA-N |
| XLogP | 3.84 |
| TPSA | 38.05 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 280.35 |
| LogP ≤ 5 | 3.84 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
|---|
Analyze [(4-fluoro-3-methylphenyl)-naphthalen-2-ylmethyl]hydrazine 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 [(4-fluoro-3-methylphenyl)-naphthalen-2-ylmethyl]hydrazine?
The IUPAC name of [(4-fluoro-3-methylphenyl)-naphthalen-2-ylmethyl]hydrazine (CID 105204047) is [(4-fluoro-3-methylphenyl)-naphthalen-2-ylmethyl]hydrazine.
What is the SMILES notation for [(4-fluoro-3-methylphenyl)-naphthalen-2-ylmethyl]hydrazine?
The canonical SMILES for [(4-fluoro-3-methylphenyl)-naphthalen-2-ylmethyl]hydrazine is Cc1cc(C(NN)c2ccc3ccccc3c2)ccc1F.
What is the InChIKey of [(4-fluoro-3-methylphenyl)-naphthalen-2-ylmethyl]hydrazine?
The InChIKey is LIRPKDXWXLGJDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17FN2/c1-12-10-15(8-9-17(12)19)18(21-20)16-7-6-13-4-2-3-5-14(13)11-16/h2-11,18,21H,20H2,1H3.
What are the key properties of [(4-fluoro-3-methylphenyl)-naphthalen-2-ylmethyl]hydrazine?
[(4-fluoro-3-methylphenyl)-naphthalen-2-ylmethyl]hydrazine has a molecular weight of 280.35 g/mol, XLogP of 3.84, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-fluoro-3-methylphenyl)-naphthalen-2-ylmethyl]hydrazine is sourced from PubChem (CID 105204047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).