Chemical ID: 5553151

Cc1ccc(c(c1)NC(=O)CCCOc2ccc(cc2)C(=O)C)OC
Chemical ID:
5553151
Name [?]:
4-(4-acetylphenoxy)-N-(2-methoxy-5-methyl-phenyl)-butanamide
SMILES [?]:
Cc1ccc(c(c1)NC(=O)CCCOc2ccc(cc2)C(=O)C)OC
InChi [?]:
InChI=1/C20H23NO4/c1-14-6-11-19(24-3)18(13-14)21-20(23)5-4-12-25-17-9-7-16(8-10-17)15(2)22/h6-11,13H,4-5,12H2,1-3H3,(H,21,23)
InChi Info:
AuxInfo=1/1/N:1,23,25,12,11,3,17,19,16,20,4,13,7,2,21,18,15,6,5,9,8,22,10,24,14/E:(7,8)(9,10)/rA:25nCCCCCCCNCOCCCOCCCCCCCOCOC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;d9;s9;s11;s12;s13;s14;s15;d16;s17;d18;d15s19;s18;d21;s21;s5;s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H23NO4
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:9.00872
Area:587.827
Solvation:-5.68696
Coulombic:-42.2955
Bond Count [?]
All:26
Single:18
Double:8
Rotors:9
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:341.401
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:3.38
LogP (Chemaxon):2.83

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Descriptor Annotations

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