IUPAC name
2-chloro-N-(2,3-dimethylphenyl)-N-(1-methylethyl)acetamide
SMILES
CC(C)N(c1cccc(C)c1C)C(=O)CCl
Compound class
Herbicide
Therapeutic area
Herbicide
Common name
xylachlor
IUPAC name
2-chloro-N-(2,3-dimethylphenyl)-N-(1-methylethyl)acetamide
SMILES
CC(C)N(c1cccc(C)c1C)C(=O)CCl
INCHI
InChI=1S/C13H18ClNO/c1-9(2)15(13(16)8-14)12-7-5-6-10(3)11(12)4/h5-7,9H,8H2,1-4H3
FORMULA
C13H18ClNO
Common name
xylachlor
IUPAC name
2-chloro-N-(2,3-dimethylphenyl)-N-(1-methylethyl)acetamide
Molecular weight
239.741
clogP
3.364
clogS
-3.853
HBond Acceptor
1
HBond Donor
0
Total Polar Surface Area
20.31
Number of Rings
1
Rotatable Bond
4
| Drug ID | Common name | Structure CAS | SMILE | Frequency |
|---|---|---|---|---|
| FDBF00003 | formamide |
|
C(=O)N | 0.1240 |
| FDBF00007 | propane |
|
C(C)C | 0.2412 |
| FDBF01436 | o-xylene |
|
c1c(c(ccc1)C)C | 0.0034 |
| FDBF05847 | 2-chloroacetamide |
|
NC(=O)CCl | 0.0082 |
| FDBF06536 | 2-chloro-N-propan-2-ylacetamide |
|
C(Cl)C(=O)NC(C)C | 0.0024 |
| FDBF06660 | N-(2,3-dimethylphenyl)formamide |
|
c1(c(c(ccc1)C)C)NC=O | 0.0003 |
| FDBF06661 | N-(2,3-dimethylphenyl)-N-propan-2-ylformamide |
|
c1(c(c(ccc1)C)C)N(C(C)C)C=O | 0.0003 |
| FDBF06662 | 2-chloro-N-(2,3-dimethylphenyl)acetamide |
|
c1(c(c(ccc1)C)C)NC(=O)CCl | 0.0003 |
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