About 2-[3-[6-[diphenyl(pyridin-2-yl)methyl]-2-pyridinyl]phenyl]phenol
2-[3-[6-[diphenyl(pyridin-2-yl)methyl]-2-pyridinyl]phenyl]phenol (PubChem CID 140805992) has the molecular formula C35H26N2O
and a molecular weight of 490.61 g/mol. Its IUPAC name is 2-[3-[6-[diphenyl(pyridin-2-yl)methyl]-2-pyridinyl]phenyl]phenol.
Molecular Properties
| Compound Name | 2-[3-[6-[diphenyl(pyridin-2-yl)methyl]-2-pyridinyl]phenyl]phenol |
| PubChem CID | 140805992 |
| Molecular Formula | C35H26N2O |
| Molecular Weight | 490.61 g/mol |
| Exact Mass | 490.20 |
| IUPAC Name | 2-[3-[6-[diphenyl(pyridin-2-yl)methyl]-2-pyridinyl]phenyl]phenol |
| SMILES | Oc1ccccc1-c1cccc(-c2cccc(C(c3ccccc3)(c3ccccc3)c3ccccn3)n2)c1 |
| InChI | InChI=1S/C35H26N2O/c38-32-21-8-7-19-30(32)26-13-11-14-27(25-26)31-20-12-23-34(37-31)35(28-15-3-1-4-16-28,29-17-5-2-6-18-29)33-22-9-10-24-36-33/h1-25,38H |
| InChIKey | XZGRWLNUEPRFGS-UHFFFAOYSA-N |
| XLogP | 7.90 |
| TPSA | 46.01 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 38 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 490.61 |
| LogP ≤ 5 | 7.90 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 2-[3-[6-[diphenyl(pyridin-2-yl)methyl]-2-pyridinyl]phenyl]phenol?
The IUPAC name of 2-[3-[6-[diphenyl(pyridin-2-yl)methyl]-2-pyridinyl]phenyl]phenol (CID 140805992) is 2-[3-[6-[diphenyl(pyridin-2-yl)methyl]-2-pyridinyl]phenyl]phenol.
What is the SMILES notation for 2-[3-[6-[diphenyl(pyridin-2-yl)methyl]-2-pyridinyl]phenyl]phenol?
The canonical SMILES for 2-[3-[6-[diphenyl(pyridin-2-yl)methyl]-2-pyridinyl]phenyl]phenol is Oc1ccccc1-c1cccc(-c2cccc(C(c3ccccc3)(c3ccccc3)c3ccccn3)n2)c1.
What is the InChIKey of 2-[3-[6-[diphenyl(pyridin-2-yl)methyl]-2-pyridinyl]phenyl]phenol?
The InChIKey is XZGRWLNUEPRFGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H26N2O/c38-32-21-8-7-19-30(32)26-13-11-14-27(25-26)31-20-12-23-34(37-31)35(28-15-3-1-4-16-28,29-17-5-2-6-18-29)33-22-9-10-24-36-33/h1-25,38H.
What are the key properties of 2-[3-[6-[diphenyl(pyridin-2-yl)methyl]-2-pyridinyl]phenyl]phenol?
2-[3-[6-[diphenyl(pyridin-2-yl)methyl]-2-pyridinyl]phenyl]phenol has a molecular weight of 490.61 g/mol, XLogP of 7.90, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[6-[diphenyl(pyridin-2-yl)methyl]-2-pyridinyl]phenyl]phenol is sourced from PubChem (CID 140805992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).