About 2-(1H-pyrrol-2-yl)-6-[5-[3-[5-[6-(1H-pyrrol-2-yl)-2-pyridinyl]-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-2-yl]pyridine
2-(1H-pyrrol-2-yl)-6-[5-[3-[5-[6-(1H-pyrrol-2-yl)-2-pyridinyl]-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-2-yl]pyridine (PubChem CID 141356480) has the molecular formula C32H24N6
and a molecular weight of 492.59 g/mol. Its IUPAC name is 2-(1H-pyrrol-2-yl)-6-[5-[3-[5-[6-(1H-pyrrol-2-yl)-2-pyridinyl]-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-2-yl]pyridine.
Molecular Properties
| Compound Name | 2-(1H-pyrrol-2-yl)-6-[5-[3-[5-[6-(1H-pyrrol-2-yl)-2-pyridinyl]-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-2-yl]pyridine |
| PubChem CID | 141356480 |
| Molecular Formula | C32H24N6 |
| Molecular Weight | 492.59 g/mol |
| Exact Mass | 492.21 |
| IUPAC Name | 2-(1H-pyrrol-2-yl)-6-[5-[3-[5-[6-(1H-pyrrol-2-yl)-2-pyridinyl]-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-2-yl]pyridine |
| SMILES | c1cc(-c2ccc(-c3cccc(-c4ccc[nH]4)n3)[nH]2)cc(-c2ccc(-c3cccc(-c4ccc[nH]4)n3)[nH]2)c1 |
| InChI | InChI=1S/C32H24N6/c1-6-21(23-14-16-31(35-23)29-10-2-8-27(37-29)25-12-4-18-33-25)20-22(7-1)24-15-17-32(36-24)30-11-3-9-28(38-30)26-13-5-19-34-26/h1-20,33-36H |
| InChIKey | RSSMUNDQSLMADP-UHFFFAOYSA-N |
| XLogP | 7.79 |
| TPSA | 88.94 Ų |
| H-Bond Donors | 4 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 38 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 492.59 |
| LogP ≤ 5 | 7.79 |
| H-Bond Donors ≤ 5 | 4 |
| H-Bond Acceptors ≤ 10 | 2 |
Analyze 2-(1H-pyrrol-2-yl)-6-[5-[3-[5-[6-(1H-pyrrol-2-yl)-2-pyridinyl]-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-2-yl]pyridine with MolForge
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Frequently Asked Questions
What is the IUPAC name of 2-(1H-pyrrol-2-yl)-6-[5-[3-[5-[6-(1H-pyrrol-2-yl)-2-pyridinyl]-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-2-yl]pyridine?
The IUPAC name of 2-(1H-pyrrol-2-yl)-6-[5-[3-[5-[6-(1H-pyrrol-2-yl)-2-pyridinyl]-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-2-yl]pyridine (CID 141356480) is 2-(1H-pyrrol-2-yl)-6-[5-[3-[5-[6-(1H-pyrrol-2-yl)-2-pyridinyl]-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-2-yl]pyridine.
What is the SMILES notation for 2-(1H-pyrrol-2-yl)-6-[5-[3-[5-[6-(1H-pyrrol-2-yl)-2-pyridinyl]-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-2-yl]pyridine?
The canonical SMILES for 2-(1H-pyrrol-2-yl)-6-[5-[3-[5-[6-(1H-pyrrol-2-yl)-2-pyridinyl]-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-2-yl]pyridine is c1cc(-c2ccc(-c3cccc(-c4ccc[nH]4)n3)[nH]2)cc(-c2ccc(-c3cccc(-c4ccc[nH]4)n3)[nH]2)c1.
What is the InChIKey of 2-(1H-pyrrol-2-yl)-6-[5-[3-[5-[6-(1H-pyrrol-2-yl)-2-pyridinyl]-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-2-yl]pyridine?
The InChIKey is RSSMUNDQSLMADP-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H24N6/c1-6-21(23-14-16-31(35-23)29-10-2-8-27(37-29)25-12-4-18-33-25)20-22(7-1)24-15-17-32(36-24)30-11-3-9-28(38-30)26-13-5-19-34-26/h1-20,33-36H.
What are the key properties of 2-(1H-pyrrol-2-yl)-6-[5-[3-[5-[6-(1H-pyrrol-2-yl)-2-pyridinyl]-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-2-yl]pyridine?
2-(1H-pyrrol-2-yl)-6-[5-[3-[5-[6-(1H-pyrrol-2-yl)-2-pyridinyl]-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-2-yl]pyridine has a molecular weight of 492.59 g/mol, XLogP of 7.79, 6 rotatable bonds, 4 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-pyrrol-2-yl)-6-[5-[3-[5-[6-(1H-pyrrol-2-yl)-2-pyridinyl]-1H-pyrrol-2-yl]phenyl]-1H-pyrrol-2-yl]pyridine is sourced from PubChem (CID 141356480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).