About 3-[2-(3-fluorophenyl)-2-phenylethyl]pyridine
3-[2-(3-fluorophenyl)-2-phenylethyl]pyridine (PubChem CID 176898824) has the molecular formula C19H16FN
and a molecular weight of 277.34 g/mol. Its IUPAC name is 3-[2-(3-fluorophenyl)-2-phenylethyl]pyridine.
Molecular Properties
| Compound Name | 3-[2-(3-fluorophenyl)-2-phenylethyl]pyridine |
| PubChem CID | 176898824 |
| Molecular Formula | C19H16FN |
| Molecular Weight | 277.34 g/mol |
| Exact Mass | 277.13 |
| IUPAC Name | 3-[2-(3-fluorophenyl)-2-phenylethyl]pyridine |
| SMILES | Fc1cccc(C(Cc2cccnc2)c2ccccc2)c1 |
| InChI | InChI=1S/C19H16FN/c20-18-10-4-9-17(13-18)19(16-7-2-1-3-8-16)12-15-6-5-11-21-14-15/h1-11,13-14,19H,12H2 |
| InChIKey | MYJZIBZJALMMJX-UHFFFAOYSA-N |
| XLogP | 4.60 |
| TPSA | 12.89 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 277.34 |
| LogP ≤ 5 | 4.60 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of 3-[2-(3-fluorophenyl)-2-phenylethyl]pyridine?
The IUPAC name of 3-[2-(3-fluorophenyl)-2-phenylethyl]pyridine (CID 176898824) is 3-[2-(3-fluorophenyl)-2-phenylethyl]pyridine.
What is the SMILES notation for 3-[2-(3-fluorophenyl)-2-phenylethyl]pyridine?
The canonical SMILES for 3-[2-(3-fluorophenyl)-2-phenylethyl]pyridine is Fc1cccc(C(Cc2cccnc2)c2ccccc2)c1.
What is the InChIKey of 3-[2-(3-fluorophenyl)-2-phenylethyl]pyridine?
The InChIKey is MYJZIBZJALMMJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16FN/c20-18-10-4-9-17(13-18)19(16-7-2-1-3-8-16)12-15-6-5-11-21-14-15/h1-11,13-14,19H,12H2.
What are the key properties of 3-[2-(3-fluorophenyl)-2-phenylethyl]pyridine?
3-[2-(3-fluorophenyl)-2-phenylethyl]pyridine has a molecular weight of 277.34 g/mol, XLogP of 4.60, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(3-fluorophenyl)-2-phenylethyl]pyridine is sourced from PubChem (CID 176898824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).