About 3-(3-phenylphenyl)-5-(pyridin-3-ylamino)phenol
3-(3-phenylphenyl)-5-(pyridin-3-ylamino)phenol (PubChem CID 68841722) has the molecular formula C23H18N2O
and a molecular weight of 338.41 g/mol. Its IUPAC name is 3-(3-phenylphenyl)-5-(pyridin-3-ylamino)phenol.
Molecular Properties
| Compound Name | 3-(3-phenylphenyl)-5-(pyridin-3-ylamino)phenol |
| PubChem CID | 68841722 |
| Molecular Formula | C23H18N2O |
| Molecular Weight | 338.41 g/mol |
| Exact Mass | 338.14 |
| IUPAC Name | 3-(3-phenylphenyl)-5-(pyridin-3-ylamino)phenol |
| SMILES | Oc1cc(Nc2cccnc2)cc(-c2cccc(-c3ccccc3)c2)c1 |
| InChI | InChI=1S/C23H18N2O/c26-23-14-20(13-22(15-23)25-21-10-5-11-24-16-21)19-9-4-8-18(12-19)17-6-2-1-3-7-17/h1-16,25-26H |
| InChIKey | OSUIREGOHDQSLS-UHFFFAOYSA-N |
| XLogP | 5.86 |
| TPSA | 45.15 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 26 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 338.41 |
| LogP ≤ 5 | 5.86 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 3-(3-phenylphenyl)-5-(pyridin-3-ylamino)phenol?
The IUPAC name of 3-(3-phenylphenyl)-5-(pyridin-3-ylamino)phenol (CID 68841722) is 3-(3-phenylphenyl)-5-(pyridin-3-ylamino)phenol.
What is the SMILES notation for 3-(3-phenylphenyl)-5-(pyridin-3-ylamino)phenol?
The canonical SMILES for 3-(3-phenylphenyl)-5-(pyridin-3-ylamino)phenol is Oc1cc(Nc2cccnc2)cc(-c2cccc(-c3ccccc3)c2)c1.
What is the InChIKey of 3-(3-phenylphenyl)-5-(pyridin-3-ylamino)phenol?
The InChIKey is OSUIREGOHDQSLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18N2O/c26-23-14-20(13-22(15-23)25-21-10-5-11-24-16-21)19-9-4-8-18(12-19)17-6-2-1-3-7-17/h1-16,25-26H.
What are the key properties of 3-(3-phenylphenyl)-5-(pyridin-3-ylamino)phenol?
3-(3-phenylphenyl)-5-(pyridin-3-ylamino)phenol has a molecular weight of 338.41 g/mol, XLogP of 5.86, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-phenylphenyl)-5-(pyridin-3-ylamino)phenol is sourced from PubChem (CID 68841722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).