Chemical ID: 4209381

Cc1ccc(c(c1)OCC(=O)NC(C)c2ccccc2)C
Chemical ID:
4209381
Name [?]:
2-(2,5-dimethylphenoxy)-N-(1-phenylethyl)acetamide
SMILES [?]:
Cc1ccc(c(c1)OCC(=O)NC(C)c2ccccc2)C
InChi [?]:
InChI=1/C18H21NO2/c1-13-9-10-14(2)17(11-13)21-12-18(20)19-15(3)16-7-5-4-6-8-16/h4-11,15H,12H2,1-3H3,(H,19,20)
InChi Info:
AuxInfo=1/1/N:1,21,14,18,17,19,16,20,3,4,7,9,2,5,13,15,6,10,12,11,8/E:(5,6)(7,8)/rA:21cCCCCCCCOCCONCCCCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;s9;d10;s10;s12;s13;s13;s15;d16;s17;d18;d15s19;s5;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H21NO2
All Atoms:21
Heavy Atoms:21
Chiral Atoms:1
ZAP Information [?]
Total:8.96942
Area:511.629
Solvation:-3.82131
Coulombic:-30.6843
Bond Count [?]
All:22
Single:15
Double:7
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:283.365
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:4.01
LogP (Chemaxon):3.84

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