Chemical ID: 5069169

c1cnccc1CCNCCc2ccncc2
Chemical ID:
5069169
Name [?]:
2-(4-pyridyl)-N-[2-(4-pyridyl)ethyl]ethanamine
SMILES [?]:
c1cnccc1CCNCCc2ccncc2
InChi [?]:
InChI=1/C14H17N3/c1-7-15-8-2-13(1)5-11-17-12-6-14-3-9-16-10-4-14/h1-4,7-10,17H,5-6,11-12H2
InChi Info:
AuxInfo=1/0/N:1,5,13,17,7,11,2,4,14,16,8,10,6,12,3,15,9/E:(1,2,3,4)(5,6)(7,8,9,10)(11,12)(13,14)(15,16)/rA:17nCCNCCCCCNCCCCCNCC/rB:s1;d2;s3;d4;d1s5;s6;s7;s8;s9;s10;s11;s12;d13;s14;d15;d12s16;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H17N3
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:8.62158
Area:450.296
Solvation:-2.63581
Coulombic:-18.0879
Bond Count [?]
All:18
Single:12
Double:6
Rotors:6
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:227.305
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:1.06
LogP (Chemaxon):1.23

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Descriptor Annotations

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