About diphenyl-(2-quinolin-2-ylphenyl)methanol
diphenyl-(2-quinolin-2-ylphenyl)methanol (PubChem CID 156790156) has the molecular formula C28H21NO
and a molecular weight of 387.48 g/mol. Its IUPAC name is diphenyl-(2-quinolin-2-ylphenyl)methanol.
Molecular Properties
| Compound Name | diphenyl-(2-quinolin-2-ylphenyl)methanol |
| PubChem CID | 156790156 |
| Molecular Formula | C28H21NO |
| Molecular Weight | 387.48 g/mol |
| Exact Mass | 387.16 |
| IUPAC Name | diphenyl-(2-quinolin-2-ylphenyl)methanol |
| SMILES | OC(c1ccccc1)(c1ccccc1)c1ccccc1-c1ccc2ccccc2n1 |
| InChI | InChI=1S/C28H21NO/c30-28(22-12-3-1-4-13-22,23-14-5-2-6-15-23)25-17-9-8-16-24(25)27-20-19-21-11-7-10-18-26(21)29-27/h1-20,30H |
| InChIKey | PAWJPQDDMGSKRD-UHFFFAOYSA-N |
| XLogP | 6.19 |
| TPSA | 33.12 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 30 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 387.48 |
| LogP ≤ 5 | 6.19 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of diphenyl-(2-quinolin-2-ylphenyl)methanol?
The IUPAC name of diphenyl-(2-quinolin-2-ylphenyl)methanol (CID 156790156) is diphenyl-(2-quinolin-2-ylphenyl)methanol.
What is the SMILES notation for diphenyl-(2-quinolin-2-ylphenyl)methanol?
The canonical SMILES for diphenyl-(2-quinolin-2-ylphenyl)methanol is OC(c1ccccc1)(c1ccccc1)c1ccccc1-c1ccc2ccccc2n1.
What is the InChIKey of diphenyl-(2-quinolin-2-ylphenyl)methanol?
The InChIKey is PAWJPQDDMGSKRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H21NO/c30-28(22-12-3-1-4-13-22,23-14-5-2-6-15-23)25-17-9-8-16-24(25)27-20-19-21-11-7-10-18-26(21)29-27/h1-20,30H.
What are the key properties of diphenyl-(2-quinolin-2-ylphenyl)methanol?
diphenyl-(2-quinolin-2-ylphenyl)methanol has a molecular weight of 387.48 g/mol, XLogP of 6.19, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diphenyl-(2-quinolin-2-ylphenyl)methanol is sourced from PubChem (CID 156790156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).