Chemical ID: 5311711

CN1CCN(CC1)C2CCN(CC2)Cc3ccncc3
Chemical ID:
5311711
Name [?]:
1-methyl-4-[1-(4-pyridylmethyl)-4-piperidyl]-piperazine
SMILES [?]:
CN1CCN(CC1)C2CCN(CC2)Cc3ccncc3
InChi [?]:
InChI=1/C16H26N4/c1-18-10-12-20(13-11-18)16-4-8-19(9-5-16)14-15-2-6-17-7-3-15/h2-3,6-7,16H,4-5,8-14H2,1H3
InChi Info:
AuxInfo=1/0/N:1,16,20,9,13,17,19,10,12,3,7,4,6,14,15,8,18,2,11,5/E:(2,3)(4,5)(6,7)(8,9)(10,11)(12,13)/rA:20nCNCCNCCCCCNCCCCCCNCC/rB:s1;s2;s3;s4;s5;s2s6;s5;s8;s9;s10;s11;s8s12;s11;s14;s15;d16;s17;d18;d15s19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H26N4
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:8.97587
Area:473.281
Solvation:-2.85616
Coulombic:-18.5016
Bond Count [?]
All:22
Single:19
Double:3
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:274.405
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:0.56
LogP (Chemaxon):0.4

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Descriptor Annotations

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