ChemDB: Chemical Search
Download
Chemical ID: 4245320
Chemical ID:
4245320
Name [?]:
N-[3-(methoxymethyl)phenyl]-2-(1-naphthyl)acetamide
SMILES [?]:
COCc1cccc(c1)NC(=O)Cc2cccc3c2cccc3
InChi [?]:
InChI=1/C20H19NO2/c1-23-14-15-6-4-10-18(12-15)21-20(22)13-17-9-5-8-16-7-2-3-11-19(16)17/h2-12H,13-14H2,1H3,(H,21,22)
InChi Info:
AuxInfo=1/1/N:1,22,21,6,16,5,23,17,15,7,20,9,13,3,4,18,14,8,19,11,10,12,2/rA:23nCOCCCCCCCNCOCCCCCCCCCCC/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s8;s10;d11;s11;s13;s14;d15;s16;d17;d14s18;s19;d20;s21;s18d22;/rC:;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C20H19NO2 |
All Atoms: | 23 |
Heavy Atoms: | 23 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 8.51958 |
Area: | 522.346 |
Solvation: | -4.53905 |
Coulombic: | -29.5928 |
Bond Count [?]
All: | 25 |
Single: | 16 |
Double: | 9 |
Rotors: | 6 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 305.37 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 3 |
XLogP: | 3.78 |
LogP (Chemaxon): | 3.96 |
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 |
---|