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Chemical ID: 6420557
Chemical ID:
6420557
Name [?]:
4-[2-(1-piperidyl)ethyl]pyridine
SMILES [?]:
c1cnccc1CCN2CCCCC2
InChi [?]:
InChI=1/C12H18N2/c1-2-9-14(10-3-1)11-6-12-4-7-13-8-5-12/h4-5,7-8H,1-3,6,9-11H2
InChi Info:
AuxInfo=1/0/N:12,11,13,1,5,7,2,4,10,14,8,6,3,9/E:(2,3)(4,5)(7,8)(9,10)/rA:14nCCNCCCCCNCCCCC/rB:s1;d2;s3;d4;d1s5;s6;s7;s8;s9;s10;s11;s12;s9s13;/rC:;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C12H18N2 |
All Atoms: | 14 |
Heavy Atoms: | 14 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 7.82999 |
Area: | 379.66 |
Solvation: | -1.66151 |
Coulombic: | -9.95721 |
Bond Count [?]
All: | 15 |
Single: | 12 |
Double: | 3 |
Rotors: | 3 |
Chiral: | 0 |
Rigid Segments: | 3 |
Chemical Properties
Molecular Weight: | 190.285 |
H-Bond Donors: | 0 |
H-Bond Acceptors: | 1 |
XLogP: | 1.54 |
LogP (Chemaxon): | 1.6 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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