Chemical ID: 7252244

Cc1ccc(c(c1)Cl)NC(=O)CCNC(=O)C
Chemical ID:
7252244
Name [?]:
3-acetamido-N-(2-chloro-4-methyl-phenyl)-propanamide
SMILES [?]:
Cc1ccc(c(c1)Cl)NC(=O)CCNC(=O)C
InChi [?]:
InChI=1/C12H15ClN2O2/c1-8-3-4-11(10(13)7-8)15-12(17)5-6-14-9(2)16/h3-4,7H,5-6H2,1-2H3,(H,14,16)(H,15,17)
InChi Info:
AuxInfo=1/1/N:1,17,3,4,12,13,7,2,15,6,5,10,8,14,9,16,11/rA:17nCCCCCCCClNCOCCNCOC/rB:s1;s2;d3;s4;d5;d2s6;s6;s5;s9;d10;s10;s12;s13;s14;d15;s15;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H15ClN2O2
All Atoms:32
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:8.39847
Area:459.294
Solvation:-3.0839
Coulombic:-39.8211
Bond Count [?]
All:17
Single:12
Double:5
Rotors:6
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:254.712
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:1.67
LogP (Chemaxon):0.81

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