Chemical ID: 6523849

CCCCC(CC)C(=O)Nc1cc(ccc1OCC)OCC
Chemical ID:
6523849
Name [?]:
N-(2,5-diethoxyphenyl)-2-ethyl-hexanamide
SMILES [?]:
CCCCC(CC)C(=O)Nc1cc(ccc1OCC)OCC
InChi [?]:
InChI=1/C18H29NO3/c1-5-9-10-14(6-2)18(20)19-16-13-15(21-7-3)11-12-17(16)22-8-4/h11-14H,5-10H2,1-4H3,(H,19,20)
InChi Info:
AuxInfo=1/1/N:1,7,22,19,2,6,21,18,3,4,14,15,12,5,13,11,16,8,10,9,20,17/rA:22cCCCCCCCCONCCCCCCOCCOCC/rB:s1;s2;s3;s4;s5;s6;s5;d8;s8;s10;s11;d12;s13;d14;d11s15;s16;s17;s18;s13;s20;s21;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H29NO3
All Atoms:22
Heavy Atoms:22
Chiral Atoms:1
ZAP Information [?]
Total:10.0778
Area:561.821
Solvation:-3.96773
Coulombic:-36.5223
Bond Count [?]
All:22
Single:18
Double:4
Rotors:11
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:307.428
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:4.77
LogP (Chemaxon):4.33

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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