ChemDB: Chemical Search
Download
Chemical ID: 4238794
Chemical ID:
4238794
Name [?]:
N-(4-amino-2-methoxy-phenyl)-2-methyl-propanamide
SMILES [?]:
CC(C)C(=O)Nc1ccc(cc1OC)N
InChi [?]:
InChI=1/C11H16N2O2/c1-7(2)11(14)13-9-5-4-8(12)6-10(9)15-3/h4-7H,12H2,1-3H3,(H,13,14)
InChi Info:
AuxInfo=1/1/N:1,3,14,9,8,11,2,10,7,12,4,15,6,5,13/E:(1,2)/rA:15nCCCCONCCCCCCOCN/rB:s1;s2;s2;d4;s4;s6;s7;d8;s9;d10;d7s11;s12;s13;s10;/rC:;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C11H16N2O2 |
All Atoms: | 15 |
Heavy Atoms: | 15 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 6.95996 |
Area: | 392.703 |
Solvation: | -2.85761 |
Coulombic: | -44.1437 |
Bond Count [?]
All: | 15 |
Single: | 11 |
Double: | 4 |
Rotors: | 4 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 208.257 |
H-Bond Donors: | 3 |
H-Bond Acceptors: | 4 |
XLogP: | 0.5 |
LogP (Chemaxon): | 1.53 |
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 |
---|