Chemical ID: 6443293

Cc1ccc(cc1NC(=O)C(C)C)NC(=O)C
Chemical ID:
6443293
Name [?]:
N-(5-acetamido-2-methyl-phenyl)-2-methyl-propanamide
SMILES [?]:
Cc1ccc(cc1NC(=O)C(C)C)NC(=O)C
InChi [?]:
InChI=1/C13H18N2O2/c1-8(2)13(17)15-12-7-11(14-10(4)16)6-5-9(12)3/h5-8H,1-4H3,(H,14,16)(H,15,17)
InChi Info:
AuxInfo=1/1/N:12,13,1,17,3,4,6,11,2,15,5,7,9,14,8,16,10/E:(1,2)/rA:17nCCCCCCCNCOCCCNCOC/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;d9;s9;s11;s11;s5;s14;d15;s15;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H18N2O2
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:7.92407
Area:433.105
Solvation:-2.90355
Coulombic:-39.0346
Bond Count [?]
All:17
Single:12
Double:5
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:234.294
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:1.3
LogP (Chemaxon):1.71

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