About 9-[2-methyl-3-(2-methylphenyl)phenyl]carbazole
9-[2-methyl-3-(2-methylphenyl)phenyl]carbazole (PubChem CID 67374081) has the molecular formula C26H21N
and a molecular weight of 347.46 g/mol. Its IUPAC name is 9-[2-methyl-3-(2-methylphenyl)phenyl]carbazole.
Molecular Properties
| Compound Name | 9-[2-methyl-3-(2-methylphenyl)phenyl]carbazole |
| PubChem CID | 67374081 |
| Molecular Formula | C26H21N |
| Molecular Weight | 347.46 g/mol |
| Exact Mass | 347.17 |
| IUPAC Name | 9-[2-methyl-3-(2-methylphenyl)phenyl]carbazole |
| SMILES | Cc1ccccc1-c1cccc(-n2c3ccccc3c3ccccc32)c1C |
| InChI | InChI=1S/C26H21N/c1-18-10-3-4-11-20(18)21-14-9-17-24(19(21)2)27-25-15-7-5-12-22(25)23-13-6-8-16-26(23)27/h3-17H,1-2H3 |
| InChIKey | ODVYLKOGPIJIBU-UHFFFAOYSA-N |
| XLogP | 7.07 |
| TPSA | 4.93 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 27 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 347.46 |
| LogP ≤ 5 | 7.07 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
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Frequently Asked Questions
What is the IUPAC name of 9-[2-methyl-3-(2-methylphenyl)phenyl]carbazole?
The IUPAC name of 9-[2-methyl-3-(2-methylphenyl)phenyl]carbazole (CID 67374081) is 9-[2-methyl-3-(2-methylphenyl)phenyl]carbazole.
What is the SMILES notation for 9-[2-methyl-3-(2-methylphenyl)phenyl]carbazole?
The canonical SMILES for 9-[2-methyl-3-(2-methylphenyl)phenyl]carbazole is Cc1ccccc1-c1cccc(-n2c3ccccc3c3ccccc32)c1C.
What is the InChIKey of 9-[2-methyl-3-(2-methylphenyl)phenyl]carbazole?
The InChIKey is ODVYLKOGPIJIBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H21N/c1-18-10-3-4-11-20(18)21-14-9-17-24(19(21)2)27-25-15-7-5-12-22(25)23-13-6-8-16-26(23)27/h3-17H,1-2H3.
What are the key properties of 9-[2-methyl-3-(2-methylphenyl)phenyl]carbazole?
9-[2-methyl-3-(2-methylphenyl)phenyl]carbazole has a molecular weight of 347.46 g/mol, XLogP of 7.07, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[2-methyl-3-(2-methylphenyl)phenyl]carbazole is sourced from PubChem (CID 67374081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).