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Chemical ID: 5023823
Chemical ID:
5023823
Name [?]:
N-(2-acetamidocyclohexyl)acetamide
SMILES [?]:
CC(=O)NC1CCCCC1NC(=O)C
InChi [?]:
InChI=1/C10H18N2O2/c1-7(13)11-9-5-3-4-6-10(9)12-8(2)14/h9-10H,3-6H2,1-2H3,(H,11,13)(H,12,14)
InChi Info:
AuxInfo=1/1/N:1,14,7,8,6,9,2,12,5,10,4,11,3,13/E:(1,2)(3,4)(5,6)(7,8)(9,10)(11,12)(13,14)/gE:(1,2)/rA:14cCCONCCCCCCNCOC/rB:s1;d2;s2;s4;s5;s6;s7;s8;s5s9;s10;s11;d12;s12;/rC:;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C10H18N2O2 |
All Atoms: | 14 |
Heavy Atoms: | 14 |
Chiral Atoms: | 2 |
ZAP Information [?]
Total: | 6.71613 |
Area: | 380.964 |
Solvation: | -2.80798 |
Coulombic: | -39.2875 |
Bond Count [?]
All: | 14 |
Single: | 12 |
Double: | 2 |
Rotors: | 4 |
Chiral: | 0 |
Rigid Segments: | 3 |
Chemical Properties
Molecular Weight: | 198.262 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 4 |
XLogP: | 0.51 |
LogP (Chemaxon): | -0.49 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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