Chemical ID: 6990091

Cc1cc(cc(c1)OCC(=O)Nc2cccc3c2cccc3)C
Chemical ID:
6990091
Name [?]:
2-(3,5-dimethylphenoxy)-N-(1-naphthyl)acetamide
SMILES [?]:
Cc1cc(cc(c1)OCC(=O)Nc2cccc3c2cccc3)C
InChi [?]:
InChI=1/C20H19NO2/c1-14-10-15(2)12-17(11-14)23-13-20(22)21-19-9-5-7-16-6-3-4-8-18(16)19/h3-12H,13H2,1-2H3,(H,21,22)
InChi Info:
AuxInfo=1/1/N:1,23,21,20,15,22,16,19,14,3,7,5,9,2,4,17,6,18,13,10,12,11,8/E:(1,2)(11,12)(14,15)/rA:23nCCCCCCCOCCONCCCCCCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;s9;d10;s10;s12;s13;d14;s15;d16;d13s17;s18;d19;s20;s17d21;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H19NO2
All Atoms:42
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:8.97106
Area:523.103
Solvation:-4.10653
Coulombic:-30.0278
Bond Count [?]
All:25
Single:16
Double:9
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:305.37
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:4.82
LogP (Chemaxon):4.81

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Descriptor Annotations

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