Chemical ID: 7517340

Cc1ccc(cc1)NC(=O)C(C23CC4CC(C2)CC(C4)C3)NC(=O)C5CCCCC5
Chemical ID:
7517340
Name [?]:
N-[1-adamantyl-(p-tolylcarbamoyl)methyl]cyclohexanecarboxamide
SMILES [?]:
Cc1ccc(cc1)NC(=O)C(C23CC4CC(C2)CC(C4)C3)NC(=O)C5CCCCC5
InChi [?]:
InChI=1/C26H36N2O2/c1-17-7-9-22(10-8-17)27-25(30)23(28-24(29)21-5-3-2-4-6-21)26-14-18-11-19(15-26)13-20(12-18)16-26/h7-10,18-21,23H,2-6,11-16H2,1H3,(H,27,30)(H,28,29)
InChi Info:
AuxInfo=1/1/N:1,28,27,29,26,30,3,7,4,6,15,18,20,17,13,21,2,16,14,19,25,5,11,23,9,12,8,22,24,10/E:(3,4)(5,6)(7,8)(9,10)(11,12,13)(14,15,16)(18,19,20)/rA:30cCCCCCCCNCOCCCCCCCCCCCNCOCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s5;s8;d9;s9;s11;s12;s13;s14;s15;s12s16;s16;s18;s14s19;s12s19;s11;s22;d23;s23;s25;s26;s27;s28;s25s29;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C26H36N2O2
All Atoms:66
Heavy Atoms:30
Chiral Atoms:None
ZAP Information [?]
Total:12.8419
Area:605.91
Solvation:-2.30582
Coulombic:-44.7127
Bond Count [?]
All:34
Single:29
Double:5
Rotors:7
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:5.53
LogP (Chemaxon):None

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue