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Chemical ID: 6516710
Chemical ID:
6516710
Name [?]:
N,N'-dicyclooctyloxamide
SMILES [?]:
C1CCCC(CCC1)NC(=O)C(=O)NC2CCCCCCC2
InChi [?]:
InChI=1/C18H32N2O2/c21-17(19-15-11-7-3-1-4-8-12-15)18(22)20-16-13-9-5-2-6-10-14-16/h15-16H,1-14H2,(H,19,21)(H,20,22)
InChi Info:
AuxInfo=1/1/N:1,19,2,8,18,20,3,7,17,21,4,6,16,22,5,15,10,12,9,14,11,13/E:(1,2)(3,4,5,6)(7,8,9,10)(11,12,13,14)(15,16)(17,18)(19,20)(21,22)/gE:(1,2)/rA:22nCCCCCCCCNCOCONCCCCCCCC/rB:s1;s2;s3;s4;s5;s6;s1s7;s5;s9;d10;s10;d12;s12;s14;s15;s16;s17;s18;s19;s20;s15s21;/rC:;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C18H32N2O2 |
All Atoms: | 22 |
Heavy Atoms: | 22 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 11.6265 |
Area: | 516.916 |
Solvation: | -1.29641 |
Coulombic: | -49.6687 |
Bond Count [?]
All: | 23 |
Single: | 21 |
Double: | 2 |
Rotors: | 5 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 308.459 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 4 |
XLogP: | 4.82 |
LogP (Chemaxon): | 3.28 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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