IUPAC name
2-chloro-N-(2,6-diethylphenyl)-N-(methoxymethyl)acetamide
SMILES
CCc1cccc(CC)c1N(COC)C(=O)CCl
Compound class
Herbicide
Therapeutic area
Herbicide
Common name
alachlor
IUPAC name
2-chloro-N-(2,6-diethylphenyl)-N-(methoxymethyl)acetamide
SMILES
CCc1cccc(CC)c1N(COC)C(=O)CCl
INCHI
InChI=1S/C14H20ClNO2/c1-4-11-7-6-8-12(5-2)14(11)16(10-18-3)13(17)9-15/h6-8H,4-5,9-10H2,1-3H3
FORMULA
C14H20ClNO2
Common name
alachlor
IUPAC name
2-chloro-N-(2,6-diethylphenyl)-N-(methoxymethyl)acetamide
Molecular weight
269.767
clogP
3.492
clogS
-4.366
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 |
|---|---|---|---|---|
| FDBF00005 | benzene |
|
c1ccccc1 | 0.2824 |
| FDBF02771 | N-(2-ethylphenyl)formamide |
|
c1(c(cccc1)NC=O)CC | 0.0024 |
| FDBF04096 | N-methyl-N-phenyl-formamide |
|
O=CN(C)c1ccccc1 | 0.0024 |
| FDBF05627 | 2-chloro-N-phenylacetamide |
|
c1c(cccc1)NC(=O)CCl | 0.0031 |
| FDBF05632 | N-(2-ethylphenyl)-N-methylformamide |
|
c1c(c(ccc1)CC)N(C=O)C | 0.0017 |
| FDBF05634 | 2-chloro-N-methyl-N-phenylacetamide |
|
c1c(cccc1)N(C(=O)CCl)C | 0.0017 |
| FDBF05847 | 2-chloroacetamide |
|
NC(=O)CCl | 0.0082 |
17 ,
2
