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Chemical ID: 6497903
Chemical ID:
6497903
Name [?]:
N-[2-(1-piperidyl)ethyl]pyridine-2-carboxamide
SMILES [?]:
c1ccnc(c1)C(=O)NCCN2CCCCC2
InChi [?]:
InChI=1/C13H19N3O/c17-13(12-6-2-3-7-14-12)15-8-11-16-9-4-1-5-10-16/h2-3,6-7H,1,4-5,8-11H2,(H,15,17)
InChi Info:
AuxInfo=1/1/N:15,1,2,14,16,6,3,10,13,17,11,5,7,4,9,12,8/E:(4,5)(9,10)/rA:17nCCCNCCCONCCNCCCCC/rB:s1;d2;s3;d4;d1s5;s5;d7;s7;s9;s10;s11;s12;s13;s14;s15;s12s16;/rC:;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C13H19N3O |
All Atoms: | 17 |
Heavy Atoms: | 17 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 8.99706 |
Area: | 440.157 |
Solvation: | -2.00686 |
Coulombic: | -33.5838 |
Bond Count [?]
All: | 18 |
Single: | 14 |
Double: | 4 |
Rotors: | 5 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 233.31 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 3 |
XLogP: | 0.98 |
LogP (Chemaxon): | 0.73 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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