Chemical ID: 5646232

CCc1ccc(cc1)NC(=O)c2cc(cc(c2)C)C
Chemical ID:
5646232
Name [?]:
N-(4-ethylphenyl)-3,5-dimethyl-benzamide
SMILES [?]:
CCc1ccc(cc1)NC(=O)c2cc(cc(c2)C)C
InChi [?]:
InChI=1/C17H19NO/c1-4-14-5-7-16(8-6-14)18-17(19)15-10-12(2)9-13(3)11-15/h5-11H,4H2,1-3H3,(H,18,19)
InChi Info:
AuxInfo=1/1/N:1,18,19,2,4,8,5,7,15,17,13,16,14,3,12,6,10,9,11/E:(2,3)(5,6)(7,8)(10,11)(12,13)/rA:19nCCCCCCCCNCOCCCCCCCC/rB:s1;s2;s3;d4;s5;d6;d3s7;s6;s9;d10;s10;s12;d13;s14;d15;d12s16;s16;s14;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H19NO
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:10.0432
Area:469.284
Solvation:-1.68893
Coulombic:-23.68
Bond Count [?]
All:20
Single:13
Double:7
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:253.339
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:4.77
LogP (Chemaxon):4.9

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue