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Chemical ID: 6941792
Chemical ID:
6941792
Name [?]:
N-[2-(1-piperidyl)phenyl]pentanamide
SMILES [?]:
CCCCC(=O)Nc1ccccc1N2CCCCC2
InChi [?]:
InChI=1/C16H24N2O/c1-2-3-11-16(19)17-14-9-5-6-10-15(14)18-12-7-4-8-13-18/h5-6,9-10H,2-4,7-8,11-13H2,1H3,(H,17,19)
InChi Info:
AuxInfo=1/1/N:1,2,3,17,10,11,16,18,9,12,4,15,19,8,13,5,7,14,6/E:(7,8)(12,13)/rA:19nCCCCCONCCCCCCNCCCCC/rB:s1;s2;s3;s4;d5;s5;s7;s8;d9;s10;d11;d8s12;s13;s14;s15;s16;s17;s14s18;/rC:;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C16H24N2O |
All Atoms: | 43 |
Heavy Atoms: | 19 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 9.85424 |
Area: | 475.871 |
Solvation: | -2.04254 |
Coulombic: | -27.942 |
Bond Count [?]
All: | 20 |
Single: | 16 |
Double: | 4 |
Rotors: | 6 |
Chiral: | 0 |
Rigid Segments: | 5 |
Chemical Properties
Molecular Weight: | 260.375 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 3 |
XLogP: | 3.74 |
LogP (Chemaxon): | 3.78 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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