Chemical ID: 5211155

CCNC(=O)NC(=O)C(C)(C)Oc1ccc(cc1)Cl
Chemical ID:
5211155
Name [?]:
2-(4-chlorophenoxy)-N-(ethylcarbamoyl)-2-methyl-propanamide
SMILES [?]:
CCNC(=O)NC(=O)C(C)(C)Oc1ccc(cc1)Cl
InChi [?]:
InChI=1/C13H17ClN2O3/c1-4-15-12(18)16-11(17)13(2,3)19-10-7-5-9(14)6-8-10/h5-8H,4H2,1-3H3,(H2,15,16,17,18)
InChi Info:
AuxInfo=1/1/N:1,10,11,2,15,17,14,18,16,13,7,4,9,19,3,6,8,5,12/E:(2,3)(5,6)(7,8)/rA:19nCCNCONCOCCCOCCCCCCCl/rB:s1;s2;s3;d4;s4;s6;d7;s7;s9;s9;s9;s12;s13;d14;s15;d16;d13s17;s16;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H17ClN2O3
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:6.89424
Area:478.44
Solvation:-5.06676
Coulombic:-50.3875
Bond Count [?]
All:19
Single:14
Double:5
Rotors:7
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:284.738
H-Bond Donors:2
H-Bond Acceptors:5
XLogP:2.88
LogP (Chemaxon):2.04

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