General Information of the Compound
| Compound ID |
CP0561532
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| Compound Name |
methyl 4-(N-propanoylanilino)piperidine-4-carboxylate
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| Structure |
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| Formula |
C16H22N2O3
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| Molecular Weight |
290.363
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| Canonical SMILES |
CCC(=O)N(c1ccccc1)C1(CCNCC1)C(=O)OC
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| InChI |
InChI=1S/C16H22N2O3/c1-3-14(19)18(13-7-5-4-6-8-13)16(15(20)21-2)9-11-17-12-10-16/h4-8,17H,3,9-12H2,1-2H3
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| InChIKey |
HFNFODVRYCEIQL-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