About phenyl-(6-phenyl-3-pyridinyl)methanone
phenyl-(6-phenyl-3-pyridinyl)methanone (PubChem CID 10890606) has the molecular formula C18H13NO
and a molecular weight of 259.31 g/mol. Its IUPAC name is phenyl-(6-phenyl-3-pyridinyl)methanone.
Molecular Properties
| Compound Name | phenyl-(6-phenyl-3-pyridinyl)methanone |
| PubChem CID | 10890606 |
| Molecular Formula | C18H13NO |
| Molecular Weight | 259.31 g/mol |
| Exact Mass | 259.10 |
| IUPAC Name | phenyl-(6-phenyl-3-pyridinyl)methanone |
| SMILES | O=C(c1ccccc1)c1ccc(-c2ccccc2)nc1 |
| InChI | InChI=1S/C18H13NO/c20-18(15-9-5-2-6-10-15)16-11-12-17(19-13-16)14-7-3-1-4-8-14/h1-13H |
| InChIKey | DIOIXAMPPPIEDR-UHFFFAOYSA-N |
| XLogP | 3.98 |
| TPSA | 29.96 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 259.31 |
| LogP ≤ 5 | 3.98 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of phenyl-(6-phenyl-3-pyridinyl)methanone?
The IUPAC name of phenyl-(6-phenyl-3-pyridinyl)methanone (CID 10890606) is phenyl-(6-phenyl-3-pyridinyl)methanone.
What is the SMILES notation for phenyl-(6-phenyl-3-pyridinyl)methanone?
The canonical SMILES for phenyl-(6-phenyl-3-pyridinyl)methanone is O=C(c1ccccc1)c1ccc(-c2ccccc2)nc1.
What is the InChIKey of phenyl-(6-phenyl-3-pyridinyl)methanone?
The InChIKey is DIOIXAMPPPIEDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13NO/c20-18(15-9-5-2-6-10-15)16-11-12-17(19-13-16)14-7-3-1-4-8-14/h1-13H.
What are the key properties of phenyl-(6-phenyl-3-pyridinyl)methanone?
phenyl-(6-phenyl-3-pyridinyl)methanone has a molecular weight of 259.31 g/mol, XLogP of 3.98, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl-(6-phenyl-3-pyridinyl)methanone is sourced from PubChem (CID 10890606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).