6-bromo-2-cyclopropyl-7-ethoxyimidazo[1,2-a]pyridine;2-cyclopropyl-7-ethoxyimidazo[1,2-a]pyridin-6-amine;N-(2-cyclopropyl-7-ethoxyimidazo[1,2-a]pyridin-6-yl)-1,1-diphenylmethanimine;2-(2-cyclopropyl-7-ethoxyimidazo[1,2-a]pyridin-6-yl)-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone
C69H69BrF3N11O5 — CID 165028821
Data last refreshed: (MolForge compound catalog, from PubChem)
About 6-bromo-2-cyclopropyl-7-ethoxyimidazo[1,2-a]pyridine;2-cyclopropyl-7-ethoxyimidazo[1,2-a]pyridin-6-amine;N-(2-cyclopropyl-7-ethoxyimidazo[1,2-a]pyridin-6-yl)-1,1-diphenylmethanimine;2-(2-cyclopropyl-7-ethoxyimidazo[1,2-a]pyridin-6-yl)-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone
6-bromo-2-cyclopropyl-7-ethoxyimidazo[1,2-a]pyridine;2-cyclopropyl-7-ethoxyimidazo[1,2-a]pyridin-6-amine;N-(2-cyclopropyl-7-ethoxyimidazo[1,2-a]pyridin-6-yl)-1,1-diphenylmethanimine;2-(2-cyclopropyl-7-ethoxyimidazo[1,2-a]pyridin-6-yl)-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone (PubChem CID 165028821) has the molecular formula C69H69BrF3N11O5 and a molecular weight of 1269.28 g/mol. Its IUPAC name is 6-bromo-2-cyclopropyl-7-ethoxyimidazo[1,2-a]pyridine;2-cyclopropyl-7-ethoxyimidazo[1,2-a]pyridin-6-amine;N-(2-cyclopropyl-7-ethoxyimidazo[1,2-a]pyridin-6-yl)-1,1-diphenylmethanimine;2-(2-cyclopropyl-7-ethoxyimidazo[1,2-a]pyridin-6-yl)-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone.
Molecular Properties
| Compound Name | 6-bromo-2-cyclopropyl-7-ethoxyimidazo[1,2-a]pyridine;2-cyclopropyl-7-ethoxyimidazo[1,2-a]pyridin-6-amine;N-(2-cyclopropyl-7-ethoxyimidazo[1,2-a]pyridin-6-yl)-1,1-diphenylmethanimine;2-(2-cyclopropyl-7-ethoxyimidazo[1,2-a]pyridin-6-yl)-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone |
|---|---|
| PubChem CID | 165028821 |
| Molecular Formula | C69H69BrF3N11O5 |
| Molecular Weight | 1269.28 g/mol |
| Exact Mass | 1267.46 |
| IUPAC Name | 6-bromo-2-cyclopropyl-7-ethoxyimidazo[1,2-a]pyridine;2-cyclopropyl-7-ethoxyimidazo[1,2-a]pyridin-6-amine;N-(2-cyclopropyl-7-ethoxyimidazo[1,2-a]pyridin-6-yl)-1,1-diphenylmethanimine;2-(2-cyclopropyl-7-ethoxyimidazo[1,2-a]pyridin-6-yl)-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone |
| SMILES | CCOc1cc2nc(C3CC3)cn2cc1Br.CCOc1cc2nc(C3CC3)cn2cc1CC(=O)c1cccc(C(F)(F)F)n1.CCOc1cc2nc(C3CC3)cn2cc1N.CCOc1cc2nc(C3CC3)cn2cc1N=C(c1ccccc1)c1ccccc1 |
| InChI | InChI=1S/C25H23N3O.C20H18F3N3O2.C12H13BrN2O.C12H15N3O/c1-2-29-23-15-24-26-21(18-13-14-18)16-28(24)17-22(23)27-25(19-9-5-3-6-10-19)20-11-7-4-8-12-20;1-2-28-17-9-19-25-15(12-6-7-12)11-26(19)10-13(17)8-16(27)14-4-3-5-18(24-14)20(21,22)23;2*1-2-16-11-5-12-14-10(8-3-4-8)7-15(12)6-9(11)13/h3-12,15-18H,2,13-14H2,1H3;3-5,9-12H,2,6-8H2,1H3;5-8H,2-4H2,1H3;5-8H,2-4,13H2,1H3 |
| InChIKey | MHWWGNROJLVSSO-UHFFFAOYSA-N |
| XLogP | 15.79 |
| TPSA | 174.46 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 16 |
| Rotatable Bonds | 18 |
| Heavy Atoms | 89 |
| Complexity | — |
Lipinski Rule of Five
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 1269.28 |
| LogP ≤ 5 | 15.79 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 16 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'imine_1', 'substructure': 'N/A'} |
|---|
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Sources
- PubChem CID 165028821 — identifiers, structure, computed properties (public domain)
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