Chemical ID: 6941069

CCC(=O)NC(C)c1cc(ccc1OC)OC
Chemical ID:
6941069
Name [?]:
N-[1-(2,5-dimethoxyphenyl)ethyl]propanamide
SMILES [?]:
CCC(=O)NC(C)c1cc(ccc1OC)OC
InChi [?]:
InChI=1/C13H19NO3/c1-5-13(15)14-9(2)11-8-10(16-3)6-7-12(11)17-4/h6-9H,5H2,1-4H3,(H,14,15)
InChi Info:
AuxInfo=1/1/N:1,7,17,15,2,11,12,9,6,10,8,13,3,5,4,16,14/rA:17cCCCONCCCCCCCCOCOC/rB:s1;s2;d3;s3;s5;s6;s6;s8;d9;s10;d11;d8s12;s13;s14;s10;s16;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H19NO3
All Atoms:36
Heavy Atoms:17
Chiral Atoms:1
ZAP Information [?]
Total:6.53914
Area:438.415
Solvation:-4.42122
Coulombic:-34.5151
Bond Count [?]
All:17
Single:13
Double:4
Rotors:6
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:237.295
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:2.03
LogP (Chemaxon):1.53

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