HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 54525186Generated: October 23, 2026
2-((5-Bromo-3-pyridinyl)methylene)-1-azabicyclo[2.2.2]octan-3-one
https://huagongshe.com/en/chemical/54525186
Identifiers & Physical Properties
| Molecular formula | C13H13BrN2O |
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| Average molar mass | 293.16 g/mol |
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| SMILES | O=C1C(=Cc2cncc(Br)c2)N2CCC1CC2 |
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| InChIKey | YSQFYUWCMDYEDH-UHFFFAOYSA-N |
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| PubChem CID | 54525186 |
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Chemical & Physical Properties
| XLogP | 2.3 |
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| Topological polar surface area | 33.2 |
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| Hydrogen bond donors | 0 |
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| Hydrogen bond acceptors | 3 |
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| Rotatable bonds | 1 |
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| Heavy atoms | 17 |
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| Formal charge | 0 |
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| Complexity | 347 |
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