General Information of the Compound
| Compound ID |
CP0501609
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| Compound Name |
tert-butyl 4-(1-phenylpiperidin-4-yl)piperidine-1-carboxylate
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| Structure |
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| Formula |
C21H32N2O2
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| Molecular Weight |
344.499
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| Canonical SMILES |
CC(C)(C)OC(=O)N1CCC(CC1)C1CCN(CC1)c1ccccc1
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| InChI |
InChI=1S/C21H32N2O2/c1-21(2,3)25-20(24)23-15-11-18(12-16-23)17-9-13-22(14-10-17)19-7-5-4-6-8-19/h4-8,17-18H,9-16H2,1-3H3
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| InChIKey |
FJRWMVVJEPYPMD-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound