Chemical ID: 4146226

Cc1ccccc1NC(=O)COc2cc(cc(c2)C)C
Chemical ID:
4146226
Name [?]:
2-(3,5-dimethylphenoxy)-N-(o-tolyl)acetamide
SMILES [?]:
Cc1ccccc1NC(=O)COc2cc(cc(c2)C)C
InChi [?]:
InChI=1/C17H19NO2/c1-12-8-13(2)10-15(9-12)20-11-17(19)18-16-7-5-4-6-14(16)3/h4-10H,11H2,1-3H3,(H,18,19)
InChi Info:
AuxInfo=1/1/N:19,20,1,4,5,3,6,16,18,14,11,17,15,2,13,7,9,8,10,12/E:(1,2)(9,10)(12,13)/rA:20nCCCCCCCNCOCOCCCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;d9;s9;s11;s12;s13;d14;s15;d16;d13s17;s17;s15;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H19NO2
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:8.21263
Area:485.01
Solvation:-3.91263
Coulombic:-29.0184
Bond Count [?]
All:21
Single:14
Double:7
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:269.338
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:3.78
LogP (Chemaxon):3.63

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Descriptor Annotations

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