Chemical ID: 5136581

CC(=O)NC(c1cc(cc(c1)OC)OC)NC(=O)C
Chemical ID:
5136581
Name [?]:
N-[acetamido-(3,5-dimethoxyphenyl)-methyl]acetamide
SMILES [?]:
CC(=O)NC(c1cc(cc(c1)OC)OC)NC(=O)C
InChi [?]:
InChI=1/C13H18N2O4/c1-8(16)14-13(15-9(2)17)10-5-11(18-3)7-12(6-10)19-4/h5-7,13H,1-4H3,(H,14,16)(H,15,17)
InChi Info:
AuxInfo=1/1/N:1,19,13,15,11,7,9,2,17,6,10,8,5,4,16,3,18,12,14/E:(1,2)(3,4)(5,6)(8,9)(11,12)(14,15)(16,17)(18,19)/gE:(1,2)/rA:19nCCONCCCCCCCOCOCNCOC/rB:s1;d2;s2;s4;s5;s6;d7;s8;d9;d6s10;s10;s12;s8;s14;s5;s16;d17;s17;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H18N2O4
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:5.4112
Area:464.947
Solvation:-6.21247
Coulombic:-51.9308
Bond Count [?]
All:19
Single:14
Double:5
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:266.293
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:0.99
LogP (Chemaxon):-0.14

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Descriptor Annotations

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