Chemical ID: 6943511

Cc1cccc(c1C)NC(=O)COc2ccc(cc2)C(C)(C)C
Chemical ID:
6943511
Name [?]:
N-(2,3-dimethylphenyl)-2-(4-tert-butylphenoxy)-acetamide
SMILES [?]:
Cc1cccc(c1C)NC(=O)COc2ccc(cc2)C(C)(C)C
InChi [?]:
InChI=1/C20H25NO2/c1-14-7-6-8-18(15(14)2)21-19(22)13-23-17-11-9-16(10-12-17)20(3,4)5/h6-12H,13H2,1-5H3,(H,21,22)
InChi Info:
AuxInfo=1/1/N:1,8,21,22,23,4,3,5,16,18,15,19,12,2,7,17,14,6,10,20,9,11,13/E:(3,4,5)(9,10)(11,12)/rA:23nCCCCCCCCNCOCOCCCCCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s7;s6;s9;d10;s10;s12;s13;s14;d15;s16;d17;d14s18;s17;s20;s20;s20;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H25NO2
All Atoms:48
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:9.56831
Area:540.273
Solvation:-3.9385
Coulombic:-29.8184
Bond Count [?]
All:24
Single:17
Double:7
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:311.418
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:5.15
LogP (Chemaxon):4.79

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Descriptor Annotations

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