About 2-(2H-quinolin-1-yl)quinoline
2-(2H-quinolin-1-yl)quinoline (PubChem CID 149254118) has the molecular formula C18H14N2
and a molecular weight of 258.32 g/mol. Its IUPAC name is 2-(2H-quinolin-1-yl)quinoline.
Molecular Properties
| Compound Name | 2-(2H-quinolin-1-yl)quinoline |
| PubChem CID | 149254118 |
| Molecular Formula | C18H14N2 |
| Molecular Weight | 258.32 g/mol |
| Exact Mass | 258.12 |
| IUPAC Name | 2-(2H-quinolin-1-yl)quinoline |
| SMILES | C1=Cc2ccccc2N(c2ccc3ccccc3n2)C1 |
| InChI | InChI=1S/C18H14N2/c1-3-9-16-14(6-1)11-12-18(19-16)20-13-5-8-15-7-2-4-10-17(15)20/h1-12H,13H2 |
| InChIKey | MNURUUCRTZAXLL-UHFFFAOYSA-N |
| XLogP | 4.40 |
| TPSA | 16.13 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 258.32 |
| LogP ≤ 5 | 4.40 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 2-(2H-quinolin-1-yl)quinoline?
The IUPAC name of 2-(2H-quinolin-1-yl)quinoline (CID 149254118) is 2-(2H-quinolin-1-yl)quinoline.
What is the SMILES notation for 2-(2H-quinolin-1-yl)quinoline?
The canonical SMILES for 2-(2H-quinolin-1-yl)quinoline is C1=Cc2ccccc2N(c2ccc3ccccc3n2)C1.
What is the InChIKey of 2-(2H-quinolin-1-yl)quinoline?
The InChIKey is MNURUUCRTZAXLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N2/c1-3-9-16-14(6-1)11-12-18(19-16)20-13-5-8-15-7-2-4-10-17(15)20/h1-12H,13H2.
What are the key properties of 2-(2H-quinolin-1-yl)quinoline?
2-(2H-quinolin-1-yl)quinoline has a molecular weight of 258.32 g/mol, XLogP of 4.40, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2H-quinolin-1-yl)quinoline is sourced from PubChem (CID 149254118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).