Chemical ID: 7246909

CCOc1ccccc1NC(=O)COc2cc(cc(c2)C(C)C)C
Chemical ID:
7246909
Name [?]:
N-(2-ethoxyphenyl)-2-(3-isopropyl-5-methyl-phenoxy)-acetamide
SMILES [?]:
CCOc1ccccc1NC(=O)COc2cc(cc(c2)C(C)C)C
InChi [?]:
InChI=1/C20H25NO3/c1-5-23-19-9-7-6-8-18(19)21-20(22)13-24-17-11-15(4)10-16(12-17)14(2)3/h6-12,14H,5,13H2,1-4H3,(H,21,22)
InChi Info:
AuxInfo=1/1/N:1,22,23,24,2,7,6,8,5,18,16,20,13,21,17,19,15,9,4,11,10,12,3,14/E:(2,3)/rA:24nCCOCCCCCCNCOCOCCCCCCCCCC/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s9;s10;d11;s11;s13;s14;s15;d16;s17;d18;d15s19;s19;s21;s21;s17;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H25NO3
All Atoms:49
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:9.7592
Area:574.42
Solvation:-4.60129
Coulombic:-37.5774
Bond Count [?]
All:25
Single:18
Double:7
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:327.417
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:4.86
LogP (Chemaxon):4.63

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Descriptor Annotations

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