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Chemical ID: 6320719
Chemical ID:
6320719
Name [?]:
N-(4-diethylaminophenyl)hexanamide
SMILES [?]:
CCCCCC(=O)Nc1ccc(cc1)N(CC)CC
InChi [?]:
InChI=1/C16H26N2O/c1-4-7-8-9-16(19)17-14-10-12-15(13-11-14)18(5-2)6-3/h10-13H,4-9H2,1-3H3,(H,17,19)
InChi Info:
AuxInfo=1/1/N:1,17,19,2,16,18,3,4,5,10,14,11,13,9,12,6,8,15,7/E:(2,3)(5,6)(10,11)(12,13)/rA:19nCCCCCCONCCCCCCNCCCC/rB:s1;s2;s3;s4;s5;d6;s6;s8;s9;d10;s11;d12;d9s13;s12;s15;s16;s15;s18;/rC:;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C16H26N2O |
All Atoms: | 19 |
Heavy Atoms: | 19 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 10.4348 |
Area: | 506.09 |
Solvation: | -2.21745 |
Coulombic: | -27.1902 |
Bond Count [?]
All: | 19 |
Single: | 15 |
Double: | 4 |
Rotors: | 9 |
Chiral: | 0 |
Rigid Segments: | 6 |
Chemical Properties
Molecular Weight: | 262.391 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 3 |
XLogP: | 4.29 |
LogP (Chemaxon): | 4.14 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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