Chemical ID: 6359979

CC1CC(CN(C1)C(=O)C23CC4CC(C2)CC(C4)C3)C
Chemical ID:
6359979
Name [?]:
1-adamantyl-(3,5-dimethyl-1-piperidyl)-methanone
SMILES [?]:
CC1CC(CN(C1)C(=O)C23CC4CC(C2)CC(C4)C3)C
InChi [?]:
InChI=1/C18H29NO/c1-12-3-13(2)11-19(10-12)17(20)18-7-14-4-15(8-18)6-16(5-14)9-18/h12-16H,3-11H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,20,3,13,16,18,15,11,19,7,5,2,4,14,12,17,8,10,6,9/E:(1,2)(4,5,6)(7,8,9)(10,11)(12,13)(14,15,16)/rA:20cCCCCCNCCOCCCCCCCCCCC/rB:s1;s2;s3;s4;s5;s2s6;s6;d8;s8;s10;s11;s12;s13;s10s14;s14;s16;s12s17;s10s17;s4;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H29NO
All Atoms:20
Heavy Atoms:20
Chiral Atoms:2
ZAP Information [?]
Total:9.5619
Area:437.645
Solvation:-1.37922
Coulombic:-18.3906
Bond Count [?]
All:23
Single:22
Double:1
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:275.429
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:4.27
LogP (Chemaxon):3.51

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