Chemical ID: 4242119

CCC(=O)Nc1cc(c(c(c1)C)OC)C
Chemical ID:
4242119
Name [?]:
N-(4-methoxy-3,5-dimethyl-phenyl)propanamide
SMILES [?]:
CCC(=O)Nc1cc(c(c(c1)C)OC)C
InChi [?]:
InChI=1/C12H17NO2/c1-5-11(14)13-10-6-8(2)12(15-4)9(3)7-10/h6-7H,5H2,1-4H3,(H,13,14)
InChi Info:
AuxInfo=1/1/N:1,12,15,14,2,11,7,10,8,6,3,9,5,4,13/E:(2,3)(6,7)(8,9)/rA:15nCCCONCCCCCCCOCC/rB:s1;s2;d3;s3;s5;s6;d7;s8;d9;d6s10;s10;s9;s13;s8;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H17NO2
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:7.08265
Area:394.992
Solvation:-2.79215
Coulombic:-26.9998
Bond Count [?]
All:15
Single:11
Double:4
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:207.269
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:1.9
LogP (Chemaxon):2.68

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Descriptor Annotations

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