About 9-(2-pyridin-3-yl-4-pyridinyl)carbazole
9-(2-pyridin-3-yl-4-pyridinyl)carbazole (PubChem CID 171768043) has the molecular formula C22H15N3
and a molecular weight of 321.38 g/mol. Its IUPAC name is 9-(2-pyridin-3-yl-4-pyridinyl)carbazole.
Molecular Properties
| Compound Name | 9-(2-pyridin-3-yl-4-pyridinyl)carbazole |
| PubChem CID | 171768043 |
| Molecular Formula | C22H15N3 |
| Molecular Weight | 321.38 g/mol |
| Exact Mass | 321.13 |
| IUPAC Name | 9-(2-pyridin-3-yl-4-pyridinyl)carbazole |
| SMILES | c1cncc(-c2cc(-n3c4ccccc4c4ccccc43)ccn2)c1 |
| InChI | InChI=1S/C22H15N3/c1-3-9-21-18(7-1)19-8-2-4-10-22(19)25(21)17-11-13-24-20(14-17)16-6-5-12-23-15-16/h1-15H |
| InChIKey | CKLIYUAFJDWKGT-UHFFFAOYSA-N |
| XLogP | 5.24 |
| TPSA | 30.71 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 25 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 321.38 |
| LogP ≤ 5 | 5.24 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 9-(2-pyridin-3-yl-4-pyridinyl)carbazole?
The IUPAC name of 9-(2-pyridin-3-yl-4-pyridinyl)carbazole (CID 171768043) is 9-(2-pyridin-3-yl-4-pyridinyl)carbazole.
What is the SMILES notation for 9-(2-pyridin-3-yl-4-pyridinyl)carbazole?
The canonical SMILES for 9-(2-pyridin-3-yl-4-pyridinyl)carbazole is c1cncc(-c2cc(-n3c4ccccc4c4ccccc43)ccn2)c1.
What is the InChIKey of 9-(2-pyridin-3-yl-4-pyridinyl)carbazole?
The InChIKey is CKLIYUAFJDWKGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H15N3/c1-3-9-21-18(7-1)19-8-2-4-10-22(19)25(21)17-11-13-24-20(14-17)16-6-5-12-23-15-16/h1-15H.
What are the key properties of 9-(2-pyridin-3-yl-4-pyridinyl)carbazole?
9-(2-pyridin-3-yl-4-pyridinyl)carbazole has a molecular weight of 321.38 g/mol, XLogP of 5.24, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(2-pyridin-3-yl-4-pyridinyl)carbazole is sourced from PubChem (CID 171768043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).