Chemical ID: 4409431

CCCCOc1ccc(cc1)C(=O)Nc2ccccc2CC
Chemical ID:
4409431
Name [?]:
4-butoxy-N-(2-ethylphenyl)-benzamide
SMILES [?]:
CCCCOc1ccc(cc1)C(=O)Nc2ccccc2CC
InChi [?]:
InChI=1/C19H23NO2/c1-3-5-14-22-17-12-10-16(11-13-17)19(21)20-18-9-7-6-8-15(18)4-2/h6-13H,3-5,14H2,1-2H3,(H,20,21)
InChi Info:
AuxInfo=1/1/N:1,22,2,21,3,18,17,19,16,8,10,7,11,4,20,9,6,15,12,14,13,5/E:(10,11)(12,13)/rA:22nCCCCOCCCCCCCONCCCCCCCC/rB:s1;s2;s3;s4;s5;s6;d7;s8;d9;d6s10;s9;d12;s12;s14;s15;d16;s17;d18;d15s19;s20;s21;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H23NO2
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:10.5571
Area:535.874
Solvation:-2.83973
Coulombic:-31.4457
Bond Count [?]
All:23
Single:16
Double:7
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:297.391
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:4.95
LogP (Chemaxon):4.27

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