Chemical ID: 4085853

Cc1ccc(c(c1)C)NC(=O)COc2ccccc2
Chemical ID:
4085853
Name [?]:
N-(2,4-dimethylphenyl)-2-phenoxy-acetamide
SMILES [?]:
Cc1ccc(c(c1)C)NC(=O)COc2ccccc2
InChi [?]:
InChI=1/C16H17NO2/c1-12-8-9-15(13(2)10-12)17-16(18)11-19-14-6-4-3-5-7-14/h3-10H,11H2,1-2H3,(H,17,18)
InChi Info:
AuxInfo=1/1/N:1,8,17,16,18,15,19,3,4,7,12,2,6,14,5,10,9,11,13/E:(4,5)(6,7)/rA:19nCCCCCCCCNCOCOCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s6;s5;s9;d10;s10;s12;s13;s14;d15;s16;d17;d14s18;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H17NO2
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:7.68718
Area:465.387
Solvation:-3.94749
Coulombic:-29.1564
Bond Count [?]
All:20
Single:13
Double:7
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:255.312
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:3.34
LogP (Chemaxon):3.16

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Descriptor Annotations

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