About 6-fluoro-8-phenylnaphthalen-2-amine
6-fluoro-8-phenylnaphthalen-2-amine (PubChem CID 142703941) has the molecular formula C16H12FN
and a molecular weight of 237.28 g/mol. Its IUPAC name is 6-fluoro-8-phenylnaphthalen-2-amine.
Molecular Properties
| Compound Name | 6-fluoro-8-phenylnaphthalen-2-amine |
| PubChem CID | 142703941 |
| Molecular Formula | C16H12FN |
| Molecular Weight | 237.28 g/mol |
| Exact Mass | 237.10 |
| IUPAC Name | 6-fluoro-8-phenylnaphthalen-2-amine |
| SMILES | Nc1ccc2cc(F)cc(-c3ccccc3)c2c1 |
| InChI | InChI=1S/C16H12FN/c17-13-8-12-6-7-14(18)10-16(12)15(9-13)11-4-2-1-3-5-11/h1-10H,18H2 |
| InChIKey | QHBMMQOCKRQVGL-UHFFFAOYSA-N |
| XLogP | 4.23 |
| TPSA | 26.02 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 237.28 |
| LogP ≤ 5 | 4.23 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'aniline', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 6-fluoro-8-phenylnaphthalen-2-amine?
The IUPAC name of 6-fluoro-8-phenylnaphthalen-2-amine (CID 142703941) is 6-fluoro-8-phenylnaphthalen-2-amine.
What is the SMILES notation for 6-fluoro-8-phenylnaphthalen-2-amine?
The canonical SMILES for 6-fluoro-8-phenylnaphthalen-2-amine is Nc1ccc2cc(F)cc(-c3ccccc3)c2c1.
What is the InChIKey of 6-fluoro-8-phenylnaphthalen-2-amine?
The InChIKey is QHBMMQOCKRQVGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12FN/c17-13-8-12-6-7-14(18)10-16(12)15(9-13)11-4-2-1-3-5-11/h1-10H,18H2.
What are the key properties of 6-fluoro-8-phenylnaphthalen-2-amine?
6-fluoro-8-phenylnaphthalen-2-amine has a molecular weight of 237.28 g/mol, XLogP of 4.23, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-8-phenylnaphthalen-2-amine is sourced from PubChem (CID 142703941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).