Chemical ID: 4462921

CCc1cc(cc(c1)OCC(=O)Nc2ccc(cc2C)C)C
Chemical ID:
4462921
Name [?]:
N-(2,4-dimethylphenyl)-2-(3-ethyl-5-methyl-phenoxy)-acetamide
SMILES [?]:
CCc1cc(cc(c1)OCC(=O)Nc2ccc(cc2C)C)C
InChi [?]:
InChI=1/C19H23NO2/c1-5-16-9-14(3)10-17(11-16)22-12-19(21)20-18-7-6-13(2)8-15(18)4/h6-11H,5,12H2,1-4H3,(H,20,21)
InChi Info:
AuxInfo=1/1/N:1,21,22,20,2,16,15,18,4,6,8,10,17,5,19,3,7,14,11,13,12,9/rA:22nCCCCCCCCOCCONCCCCCCCCC/rB:s1;s2;s3;d4;s5;d6;d3s7;s7;s9;s10;d11;s11;s13;s14;d15;s16;d17;d14s18;s19;s17;s5;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H23NO2
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:9.48537
Area:535.093
Solvation:-3.89195
Coulombic:-29.1251
Bond Count [?]
All:23
Single:16
Double:7
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:297.391
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:4.68
LogP (Chemaxon):4.49

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Descriptor Annotations

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