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Chemical ID: 4255198
Chemical ID:
4255198
Name [?]:
N-benzyl-N-methyl-piperidine-4-carboxamide
SMILES [?]:
CN(Cc1ccccc1)C(=O)C2CCNCC2
InChi [?]:
InChI=1/C14H20N2O/c1-16(11-12-5-3-2-4-6-12)14(17)13-7-9-15-10-8-13/h2-6,13,15H,7-11H2,1H3
InChi Info:
AuxInfo=1/0/N:1,7,6,8,5,9,13,17,14,16,3,4,12,10,15,2,11/E:(3,4)(5,6)(7,8)(9,10)/rA:17nCNCCCCCCCCOCCCNCC/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s2;d10;s10;s12;s13;s14;s15;s12s16;/rC:;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C14H20N2O |
All Atoms: | 17 |
Heavy Atoms: | 17 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 8.1019 |
Area: | 419.535 |
Solvation: | -2.38648 |
Coulombic: | -25.7369 |
Bond Count [?]
All: | 18 |
Single: | 14 |
Double: | 4 |
Rotors: | 4 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 232.321 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 3 |
XLogP: | 1.38 |
LogP (Chemaxon): | 1.25 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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