ChemDB: Chemical Search
Download
Chemical ID: 7481422
Chemical ID:
7481422
Name [?]:
N-(2-methoxyphenyl)-4-pentoxy-benzamide
SMILES [?]:
CCCCCOc1ccc(cc1)C(=O)Nc2ccccc2OC
InChi [?]:
InChI=1/C19H23NO3/c1-3-4-7-14-23-16-12-10-15(11-13-16)19(21)20-17-8-5-6-9-18(17)22-2/h5-6,8-13H,3-4,7,14H2,1-2H3,(H,20,21)
InChi Info:
AuxInfo=1/1/N:1,23,2,3,18,19,4,17,20,9,11,8,12,5,10,7,16,21,13,15,14,22,6/E:(10,11)(12,13)/rA:23nCCCCCOCCCCCCCONCCCCCCOC/rB:s1;s2;s3;s4;s5;s6;s7;d8;s9;d10;d7s11;s10;d13;s13;s15;s16;d17;s18;d19;d16s20;s21;s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C19H23NO3 |
All Atoms: | 46 |
Heavy Atoms: | 23 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 10.0148 |
Area: | 556.899 |
Solvation: | -3.90771 |
Coulombic: | -38.7938 |
Bond Count [?]
All: | 24 |
Single: | 17 |
Double: | 7 |
Rotors: | 9 |
Chiral: | 0 |
Rigid Segments: | 7 |
Chemical Properties
Molecular Weight: | 313.391 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 4 |
XLogP: | 4.74 |
LogP (Chemaxon): | 4.2 |
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 |
---|