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Chemical ID: 6358372
Chemical ID:
6358372
Name [?]:
N-(4-ethoxyphenyl)octanamide
SMILES [?]:
CCCCCCCC(=O)Nc1ccc(cc1)OCC
InChi [?]:
InChI=1/C16H25NO2/c1-3-5-6-7-8-9-16(18)17-14-10-12-15(13-11-14)19-4-2/h10-13H,3-9H2,1-2H3,(H,17,18)
InChi Info:
AuxInfo=1/1/N:1,19,2,18,3,4,5,6,7,12,16,13,15,11,14,8,10,9,17/E:(10,11)(12,13)/rA:19nCCCCCCCCONCCCCCCOCC/rB:s1;s2;s3;s4;s5;s6;s7;d8;s8;s10;s11;d12;s13;d14;d11s15;s14;s17;s18;/rC:;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C16H25NO2 |
All Atoms: | 19 |
Heavy Atoms: | 19 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 9.97248 |
Area: | 517.765 |
Solvation: | -2.97165 |
Coulombic: | -28.7233 |
Bond Count [?]
All: | 19 |
Single: | 15 |
Double: | 4 |
Rotors: | 10 |
Chiral: | 0 |
Rigid Segments: | 6 |
Chemical Properties
Molecular Weight: | 263.375 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 3 |
XLogP: | 4.71 |
LogP (Chemaxon): | 4.07 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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