Chemical ID: 4193249

Cc1ccc(c(c1)C)OCC(=O)N2CCC(CC2)C
Chemical ID:
4193249
Name [?]:
2-(2,4-dimethylphenoxy)-1-(4-methyl-1-piperidyl)-ethanone
SMILES [?]:
Cc1ccc(c(c1)C)OCC(=O)N2CCC(CC2)C
InChi [?]:
InChI=1/C16H23NO2/c1-12-6-8-17(9-7-12)16(18)11-19-15-5-4-13(2)10-14(15)3/h4-5,10,12H,6-9,11H2,1-3H3
InChi Info:
AuxInfo=1/0/N:19,1,8,3,4,15,17,14,18,7,10,16,2,6,5,11,13,12,9/E:(6,7)(8,9)/rA:19nCCCCCCCCOCCONCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s6;s5;s9;s10;d11;s11;s13;s14;s15;s16;s13s17;s16;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H23NO2
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:8.14942
Area:469.967
Solvation:-3.59977
Coulombic:-24.5893
Bond Count [?]
All:20
Single:16
Double:4
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:261.359
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:3.29
LogP (Chemaxon):2.95

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Descriptor Annotations

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