IUPAC name
N-[2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]ethyl]-2-(trifluoromethyl)benzamide
SMILES
c1ccc(c(c1)C(=O)NCCc1c(cc(cn1)C(F)(F)F)Cl)C(F)(F)F
Compound class
Fungicide
Therapeutic area
Fungicide
Common name
fluopyram
IUPAC name
N-[2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]ethyl]-2-(trifluoromethyl)benzamide
SMILES
c1ccc(c(c1)C(=O)NCCc1c(cc(cn1)C(F)(F)F)Cl)C(F)(F)F
INCHI
InChI=1S/C16H11ClF6N2O/c17-12-7-9(15(18,19)20)8-25-13(12)5-6-24-14(26)10-3-1-2-4-11(10)16(21,22)23/h1-4,7-8H,5-6H2,(H,24,26)
FORMULA
C16H11ClF6N2O
Common name
fluopyram
IUPAC name
N-[2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]ethyl]-2-(trifluoromethyl)benzamide
Molecular weight
396.715
clogP
6.063
clogS
-6.275
HBond Acceptor
3
HBond Donor
1
Total Polar Surface Area
45.48
Number of Rings
2
Rotatable Bond
6
| Drug ID | Common name | Structure CAS | SMILE | Frequency |
|---|---|---|---|---|
| FDBF00048 | benzamide |
|
O=C(N)c1ccccc1 | 0.0117 |
| FDBF00177 | fluoroform |
|
FC(F)F | 0.0704 |
| FDBF00858 | N-methylbenzamide |
|
CNC(=O)c1ccccc1 | 0.0031 |
| FDBF00875 | 3-chloropyridine |
|
Clc1cccnc1 | 0.0048 |
| FDBF07126 | 3-chloro-2-methylpyridine |
|
c1(ncccc1Cl)C | 0.0007 |
| FDBF07128 | 2-(trifluoromethyl)benzamide |
|
c1cc(c(cc1)C(F)(F)F)C(=O)N | 0.0003 |
| FDBF07129 | N-methyl-2-(trifluoromethyl)benzamide |
|
CNC(=O)c1ccccc1C(F)(F)F | 0.0003 |
| FDBF07130 | N-ethylbenzamide |
|
C(NC(=O)c1ccccc1)C | 0.0003 |
| FDBF07131 | 3-chloro-2-ethylpyridine |
|
CCc1ncccc1Cl | 0.0003 |
| FDBF07132 | N-ethyl-2-(trifluoromethyl)benzamide |
|
C(NC(=O)c1ccccc1C(F)(F)F)C | 0.0003 |
10 ,
2
