Chemical ID: 7154863

Cc1ccccc1C[NH+]2CCC(CC2)[NH+]3CC(CC(C3)C)C
Chemical ID:
7154863
Name [?]:
3,5-dimethyl-1-[1-(o-tolylmethyl)-3,4,5,6-tetrahydro-2H-pyridin-4-yl]-3,4,5,6-tetrahydro-2H-pyridine
SMILES [?]:
Cc1ccccc1C[NH+]2CCC(CC2)[NH+]3CC(CC(C3)C)C
InChi [?]:
InChI=1/C20H32N2/c1-16-12-17(2)14-22(13-16)20-8-10-21(11-9-20)15-19-7-5-4-6-18(19)3/h4-7,16-17,20H,8-15H2,1-3H3/p+2
InChi Info:
AuxInfo=1/1/N:21,22,1,4,5,3,6,11,13,10,14,18,20,16,8,19,17,2,7,12,9,15/E:(1,2)(8,9)(10,11)(13,14)(16,17)/rA:22cCCCCCCCCN+CCCCCN+CCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;s9;s10;s11;s12;s9s13;s12;s15;s16;s17;s18;s15s19;s19;s17;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H34N2+2
All Atoms:56
Heavy Atoms:22
Chiral Atoms:2
ZAP Information [?]
Total:-78.4636
Area:516.973
Solvation:-91.388
Coulombic:92.8681
Bond Count [?]
All:24
Single:21
Double:3
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:302.497
H-Bond Donors:2
H-Bond Acceptors:2
XLogP:4.06
LogP (Chemaxon):3.9

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Descriptor Annotations

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