Chemical ID: 4234156

CC1CC(CN(C1)C2CCN(CC2)Cc3ccccn3)C
Chemical ID:
4234156
Name [?]:
2-[[4-(3,5-dimethyl-1-piperidyl)-1-piperidyl]methyl]pyridine
SMILES [?]:
CC1CC(CN(C1)C2CCN(CC2)Cc3ccccn3)C
InChi [?]:
InChI=1/C18H29N3/c1-15-11-16(2)13-21(12-15)18-6-9-20(10-7-18)14-17-5-3-4-8-19-17/h3-5,8,15-16,18H,6-7,9-14H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,21,17,18,16,9,13,19,10,12,3,7,5,14,2,4,15,8,20,11,6/E:(1,2)(6,7)(9,10)(12,13)(15,16)/rA:21cCCCCCNCCCCNCCCCCCCCNC/rB:s1;s2;s3;s4;s5;s2s6;s6;s8;s9;s10;s11;s8s12;s11;s14;s15;d16;s17;d18;d15s19;s4;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H29N3
All Atoms:21
Heavy Atoms:21
Chiral Atoms:2
ZAP Information [?]
Total:10.2922
Area:498.693
Solvation:-2.17516
Coulombic:-15.6786
Bond Count [?]
All:23
Single:20
Double:3
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:287.443
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:2.46
LogP (Chemaxon):2.28

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