About 2-[6-(3-hydroxyphenyl)-4-pyridin-2-yl-2-pyridinyl]phenol
2-[6-(3-hydroxyphenyl)-4-pyridin-2-yl-2-pyridinyl]phenol (PubChem CID 137091036) has the molecular formula C22H16N2O2
and a molecular weight of 340.38 g/mol. Its IUPAC name is 2-[6-(3-hydroxyphenyl)-4-pyridin-2-yl-2-pyridinyl]phenol.
Molecular Properties
| Compound Name | 2-[6-(3-hydroxyphenyl)-4-pyridin-2-yl-2-pyridinyl]phenol |
| PubChem CID | 137091036 |
| Molecular Formula | C22H16N2O2 |
| Molecular Weight | 340.38 g/mol |
| Exact Mass | 340.12 |
| IUPAC Name | 2-[6-(3-hydroxyphenyl)-4-pyridin-2-yl-2-pyridinyl]phenol |
| SMILES | Oc1cccc(-c2cc(-c3ccccn3)cc(-c3ccccc3O)n2)c1 |
| InChI | InChI=1S/C22H16N2O2/c25-17-7-5-6-15(12-17)20-13-16(19-9-3-4-11-23-19)14-21(24-20)18-8-1-2-10-22(18)26/h1-14,25-26H |
| InChIKey | VDWVVZCPHIUQCH-UHFFFAOYSA-N |
| XLogP | 4.89 |
| TPSA | 66.24 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 26 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 340.38 |
| LogP ≤ 5 | 4.89 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of 2-[6-(3-hydroxyphenyl)-4-pyridin-2-yl-2-pyridinyl]phenol?
The IUPAC name of 2-[6-(3-hydroxyphenyl)-4-pyridin-2-yl-2-pyridinyl]phenol (CID 137091036) is 2-[6-(3-hydroxyphenyl)-4-pyridin-2-yl-2-pyridinyl]phenol.
What is the SMILES notation for 2-[6-(3-hydroxyphenyl)-4-pyridin-2-yl-2-pyridinyl]phenol?
The canonical SMILES for 2-[6-(3-hydroxyphenyl)-4-pyridin-2-yl-2-pyridinyl]phenol is Oc1cccc(-c2cc(-c3ccccn3)cc(-c3ccccc3O)n2)c1.
What is the InChIKey of 2-[6-(3-hydroxyphenyl)-4-pyridin-2-yl-2-pyridinyl]phenol?
The InChIKey is VDWVVZCPHIUQCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16N2O2/c25-17-7-5-6-15(12-17)20-13-16(19-9-3-4-11-23-19)14-21(24-20)18-8-1-2-10-22(18)26/h1-14,25-26H.
What are the key properties of 2-[6-(3-hydroxyphenyl)-4-pyridin-2-yl-2-pyridinyl]phenol?
2-[6-(3-hydroxyphenyl)-4-pyridin-2-yl-2-pyridinyl]phenol has a molecular weight of 340.38 g/mol, XLogP of 4.89, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(3-hydroxyphenyl)-4-pyridin-2-yl-2-pyridinyl]phenol is sourced from PubChem (CID 137091036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).