General Information of the Compound
| Compound ID |
CP0563181
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| Compound Name |
N,2,6-trimethyl-N-[(2,3,5-trifluorophenyl)methyl]piperidine-1-carboxamide
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| Structure |
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| Formula |
C16H21F3N2O
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| Molecular Weight |
314.351
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| Canonical SMILES |
CC1CCCC(C)N1C(=O)N(C)Cc1cc(F)cc(F)c1F
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| InChI |
InChI=1S/C16H21F3N2O/c1-10-5-4-6-11(2)21(10)16(22)20(3)9-12-7-13(17)8-14(18)15(12)19/h7-8,10-11H,4-6,9H2,1-3H3
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| InChIKey |
XOQAOYATPLWFQM-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