ChemDB: Chemical Search
Download
Chemical ID: 4425171
Chemical ID:
4425171
Name [?]:
N-(2-butoxyphenyl)-2-(3-methylphenoxy)-acetamide
SMILES [?]:
CCCCOc1ccccc1NC(=O)COc2cccc(c2)C
InChi [?]:
InChI=1/C19H23NO3/c1-3-4-12-22-18-11-6-5-10-17(18)20-19(21)14-23-16-9-7-8-15(2)13-16/h5-11,13H,3-4,12,14H2,1-2H3,(H,20,21)
InChi Info:
AuxInfo=1/1/N:1,23,2,3,9,8,19,20,18,10,7,4,22,15,21,17,11,6,13,12,14,5,16/rA:23nCCCCOCCCCCCNCOCOCCCCCCC/rB:s1;s2;s3;s4;s5;s6;d7;s8;d9;d6s10;s11;s12;d13;s13;s15;s16;s17;d18;s19;d20;d17s21;s21;/rC:;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C19H23NO3 |
All Atoms: | 23 |
Heavy Atoms: | 23 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 9.44128 |
Area: | 562.012 |
Solvation: | -4.60902 |
Coulombic: | -37.9037 |
Bond Count [?]
All: | 24 |
Single: | 17 |
Double: | 7 |
Rotors: | 9 |
Chiral: | 0 |
Rigid Segments: | 6 |
Chemical Properties
Molecular Weight: | 313.391 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 4 |
XLogP: | 4.38 |
LogP (Chemaxon): | 4.3 |
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 |
---|