About 4-[4-[7-[4-(4-methylphenyl)phenyl]naphthalen-2-yl]phenyl]pyridine
4-[4-[7-[4-(4-methylphenyl)phenyl]naphthalen-2-yl]phenyl]pyridine (PubChem CID 170294286) has the molecular formula C34H25N
and a molecular weight of 447.58 g/mol. Its IUPAC name is 4-[4-[7-[4-(4-methylphenyl)phenyl]naphthalen-2-yl]phenyl]pyridine.
Molecular Properties
| Compound Name | 4-[4-[7-[4-(4-methylphenyl)phenyl]naphthalen-2-yl]phenyl]pyridine |
| PubChem CID | 170294286 |
| Molecular Formula | C34H25N |
| Molecular Weight | 447.58 g/mol |
| Exact Mass | 447.20 |
| IUPAC Name | 4-[4-[7-[4-(4-methylphenyl)phenyl]naphthalen-2-yl]phenyl]pyridine |
| SMILES | Cc1ccc(-c2ccc(-c3ccc4ccc(-c5ccc(-c6ccncc6)cc5)cc4c3)cc2)cc1 |
| InChI | InChI=1S/C34H25N/c1-24-2-4-25(5-3-24)26-6-10-28(11-7-26)32-16-14-30-15-17-33(23-34(30)22-32)29-12-8-27(9-13-29)31-18-20-35-21-19-31/h2-23H,1H3 |
| InChIKey | LZLZCBCRYPTXKJ-UHFFFAOYSA-N |
| XLogP | 9.21 |
| TPSA | 12.89 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 35 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 447.58 |
| LogP ≤ 5 | 9.21 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of 4-[4-[7-[4-(4-methylphenyl)phenyl]naphthalen-2-yl]phenyl]pyridine?
The IUPAC name of 4-[4-[7-[4-(4-methylphenyl)phenyl]naphthalen-2-yl]phenyl]pyridine (CID 170294286) is 4-[4-[7-[4-(4-methylphenyl)phenyl]naphthalen-2-yl]phenyl]pyridine.
What is the SMILES notation for 4-[4-[7-[4-(4-methylphenyl)phenyl]naphthalen-2-yl]phenyl]pyridine?
The canonical SMILES for 4-[4-[7-[4-(4-methylphenyl)phenyl]naphthalen-2-yl]phenyl]pyridine is Cc1ccc(-c2ccc(-c3ccc4ccc(-c5ccc(-c6ccncc6)cc5)cc4c3)cc2)cc1.
What is the InChIKey of 4-[4-[7-[4-(4-methylphenyl)phenyl]naphthalen-2-yl]phenyl]pyridine?
The InChIKey is LZLZCBCRYPTXKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H25N/c1-24-2-4-25(5-3-24)26-6-10-28(11-7-26)32-16-14-30-15-17-33(23-34(30)22-32)29-12-8-27(9-13-29)31-18-20-35-21-19-31/h2-23H,1H3.
What are the key properties of 4-[4-[7-[4-(4-methylphenyl)phenyl]naphthalen-2-yl]phenyl]pyridine?
4-[4-[7-[4-(4-methylphenyl)phenyl]naphthalen-2-yl]phenyl]pyridine has a molecular weight of 447.58 g/mol, XLogP of 9.21, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-[7-[4-(4-methylphenyl)phenyl]naphthalen-2-yl]phenyl]pyridine is sourced from PubChem (CID 170294286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).