About 2-cyclopropylimidazo[1,2-a]pyridine-8-carbaldehyde
2-cyclopropylimidazo[1,2-a]pyridine-8-carbaldehyde (PubChem CID 84732789) has the molecular formula C11H10N2O
and a molecular weight of 186.21 g/mol. Its IUPAC name is 2-cyclopropylimidazo[1,2-a]pyridine-8-carbaldehyde.
Molecular Properties
| Compound Name | 2-cyclopropylimidazo[1,2-a]pyridine-8-carbaldehyde |
| PubChem CID | 84732789 |
| Molecular Formula | C11H10N2O |
| Molecular Weight | 186.21 g/mol |
| Exact Mass | 186.08 |
| IUPAC Name | 2-cyclopropylimidazo[1,2-a]pyridine-8-carbaldehyde |
| SMILES | O=Cc1cccn2cc(C3CC3)nc12 |
| InChI | InChI=1S/C11H10N2O/c14-7-9-2-1-5-13-6-10(8-3-4-8)12-11(9)13/h1-2,5-8H,3-4H2 |
| InChIKey | XFBGVMDGKPEXIG-UHFFFAOYSA-N |
| XLogP | 2.02 |
| TPSA | 34.37 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 186.21 |
| LogP ≤ 5 | 2.02 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'aldehyde', 'substructure': 'N/A'} |
|---|
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Frequently Asked Questions
What is the IUPAC name of 2-cyclopropylimidazo[1,2-a]pyridine-8-carbaldehyde?
The IUPAC name of 2-cyclopropylimidazo[1,2-a]pyridine-8-carbaldehyde (CID 84732789) is 2-cyclopropylimidazo[1,2-a]pyridine-8-carbaldehyde.
What is the SMILES notation for 2-cyclopropylimidazo[1,2-a]pyridine-8-carbaldehyde?
The canonical SMILES for 2-cyclopropylimidazo[1,2-a]pyridine-8-carbaldehyde is O=Cc1cccn2cc(C3CC3)nc12.
What is the InChIKey of 2-cyclopropylimidazo[1,2-a]pyridine-8-carbaldehyde?
The InChIKey is XFBGVMDGKPEXIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O/c14-7-9-2-1-5-13-6-10(8-3-4-8)12-11(9)13/h1-2,5-8H,3-4H2.
What are the key properties of 2-cyclopropylimidazo[1,2-a]pyridine-8-carbaldehyde?
2-cyclopropylimidazo[1,2-a]pyridine-8-carbaldehyde has a molecular weight of 186.21 g/mol, XLogP of 2.02, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropylimidazo[1,2-a]pyridine-8-carbaldehyde is sourced from PubChem (CID 84732789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).