IUPAC name
2-chloro-N-(ethoxymethyl)-N-(2-ethylphenyl)acetamide
SMILES
CCc1ccccc1N(COCC)C(=O)CCl
Compound class
Herbicide
Therapeutic area
Herbicide
Common name
ethachlor
IUPAC name
2-chloro-N-(ethoxymethyl)-N-(2-ethylphenyl)acetamide
SMILES
CCc1ccccc1N(COCC)C(=O)CCl
INCHI
InChI=1S/C13H18ClNO2/c1-3-11-7-5-6-8-12(11)15(10-17-4-2)13(16)9-14/h5-8H,3-4,9-10H2,1-2H3
FORMULA
C13H18ClNO2
Common name
ethachlor
IUPAC name
2-chloro-N-(ethoxymethyl)-N-(2-ethylphenyl)acetamide
Molecular weight
255.741
clogP
2.964
clogS
-3.831
HBond Acceptor
2
HBond Donor
0
Total Polar Surface Area
29.54
Number of Rings
1
Rotatable Bond
7
| Drug ID | Common name | Structure CAS | SMILE | Frequency |
|---|---|---|---|---|
| FDBF00003 | formamide |
|
C(=O)N | 0.1240 |
| FDBF00024 | N-methylformamide |
|
N(C=O)C | 0.0106 |
| FDBF00041 | ethanol |
|
CCO | 0.1474 |
| FDBF00141 | ethylbenzene |
|
c1(ccccc1)CC | 0.0371 |
| FDBF01315 | N-phenylformamide |
|
c1(ccccc1)NC=O | 0.0058 |
| FDBF05611 | 2-chloro-N-methylacetamide |
|
CNC(=O)CCl | 0.0045 |
| FDBF05618 | N-(ethoxymethyl)formamide |
|
C(NC=O)OCC | 0.0014 |
| FDBF05619 | 2-chloro-N-(hydroxymethyl)acetamide |
|
C(NC(=O)CCl)O | 0.0024 |
| FDBF05633 | 2-chloro-N-(2-ethylphenyl)acetamide |
|
c1c(c(ccc1)CC)NC(=O)CCl | 0.0024 |
| FDBF05801 | N-(hydroxymethyl)-N-phenylformamide |
|
OCN(C=O)c1ccccc1 | 0.0010 |
19 ,
2
