ChemDB: Chemical Search
Download
Chemical ID: 7092424
Chemical ID:
7092424
Name [?]:
N-(4-amino-2-methyl-phenyl)-2-(1-piperidyl)acetamide
SMILES [?]:
Cc1cc(ccc1NC(=O)CN2CCCCC2)N
InChi [?]:
InChI=1/C14H21N3O/c1-11-9-12(15)5-6-13(11)16-14(18)10-17-7-3-2-4-8-17/h5-6,9H,2-4,7-8,10,15H2,1H3,(H,16,18)
InChi Info:
AuxInfo=1/1/N:1,15,14,16,5,6,13,17,3,11,2,4,7,9,18,8,12,10/E:(3,4)(7,8)/rA:18nCCCCCCCNCOCNCCCCCN/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;d9;s9;s11;s12;s13;s14;s15;s12s16;s4;/rC:;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C14H21N3O |
All Atoms: | 39 |
Heavy Atoms: | 18 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 8.18815 |
Area: | 441.031 |
Solvation: | -2.83762 |
Coulombic: | -41.2389 |
Bond Count [?]
All: | 19 |
Single: | 15 |
Double: | 4 |
Rotors: | 4 |
Chiral: | 0 |
Rigid Segments: | 3 |
Chemical Properties
Molecular Weight: | 247.336 |
H-Bond Donors: | 3 |
H-Bond Acceptors: | 4 |
XLogP: | 0.65 |
LogP (Chemaxon): | 0.99 |
Name Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
Chemical | Mix Source | External ID | Descriptor | Value |
---|
Experimental Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
Chemical Mix | Source | External ID | Descriptor | Value |
---|
Descriptor Annotations
Note: All annotations are abbreviated. For more detailed information please download chemical.
Chemical Mix | Source | External ID | Descriptor | Value |
---|