HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 67006243Generated: November 1, 2026
1,1-Dimethylethyl 4-{[3-(4-cyano-2-pyridinyl)phenyl]methyl}-1-piperidinecarboxylate
https://huagongshe.com/en/chemical/67006243
Identifiers & Physical Properties
| Molecular formula | C23H27N3O2 |
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| Average molar mass | 377.5 g/mol |
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| Monoisotopic mass | 377.21032711 g/mol |
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| SMILES | CC(C)(C)OC(=O)N1CCC(Cc2cccc(-c3cc(C#N)ccn3)c2)CC1 |
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| InChIKey | VMKKTKOFAWQVAL-UHFFFAOYSA-N |
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| PubChem CID | 67006243 |
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Chemical & Physical Properties
| XLogP | 4.1 |
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| Topological polar surface area | 66.2 |
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| Hydrogen bond donors | 0 |
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| Hydrogen bond acceptors | 4 |
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| Rotatable bonds | 5 |
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| Heavy atoms | 28 |
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| Formal charge | 0 |
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| Complexity | 568 |
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![1,1-Dimethylethyl 4-{[3-(4-cyano-2-pyridinyl)phenyl]methyl}-1-piperidinecarboxylate molecular structure](/img/chemical/67006243.png)