Chemical ID: 6510944

CC1CC(CCC1NC(=O)C)CC2CCC(C(C2)C)NC(=O)C
Chemical ID:
6510944
Name [?]:
N-[4-[(4-acetamido-3-methyl-cyclohexyl)methyl]-2-methyl-cyclohexyl]acetamide
SMILES [?]:
CC1CC(CCC1NC(=O)C)CC2CCC(C(C2)C)NC(=O)C
InChi [?]:
InChI=1/C19H34N2O2/c1-12-9-16(5-7-18(12)20-14(3)22)11-17-6-8-19(13(2)10-17)21-15(4)23/h12-13,16-19H,5-11H2,1-4H3,(H,20,22)(H,21,23)
InChi Info:
AuxInfo=1/1/N:1,19,11,23,5,14,6,15,3,18,12,2,17,9,21,4,13,7,16,8,20,10,22/E:(1,2)(3,4)(5,6)(7,8)(9,10)(12,13)(14,15)(16,17)(18,19)(20,21)(22,23)/gE:(1,2)/rA:23cCCCCCCCNCOCCCCCCCCCNCOC/rB:s1;s2;s3;s4;s5;s2s6;s7;s8;d9;s9;s4;s12;s13;s14;s15;s16;s13s17;s17;s16;s20;d21;s21;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H34N2O2
All Atoms:23
Heavy Atoms:23
Chiral Atoms:6
ZAP Information [?]
Total:10.8217
Area:552.513
Solvation:-2.99115
Coulombic:-41.1082
Bond Count [?]
All:24
Single:22
Double:2
Rotors:6
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:322.486
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:3.78
LogP (Chemaxon):2.16

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