6-(2,4-dichlorophenyl)-4-(trifluoromethyl)-1H-pyridin-2-one

C12H6Cl2F3NO — CID 106517957

IUPAC6-(2,4-dichlorophenyl)-4-(trifluoromethyl)-1H-pyridin-2-one
SMILESO=c1cc(C(F)(F)F)cc(-c2ccc(Cl)cc2Cl)[nH]1
InChIInChI=1S/C12H6Cl2F3NO/c13-7-1-2-8(9(14)5-7)10-3-6(12(15,16)17)4-11(19)18-10/h1-5H,(H,18,19)
InChIKeyULIWVWRJAVPZHT-UHFFFAOYSA-N
MW308.09 g/mol
LogP4.37
Rot. Bonds1

About 6-(2,4-dichlorophenyl)-4-(trifluoromethyl)-1H-pyridin-2-one

6-(2,4-dichlorophenyl)-4-(trifluoromethyl)-1H-pyridin-2-one (PubChem CID 106517957) has the molecular formula C12H6Cl2F3NO and a molecular weight of 308.09 g/mol. Its IUPAC name is 6-(2,4-dichlorophenyl)-4-(trifluoromethyl)-1H-pyridin-2-one.

Molecular Properties

Compound Name6-(2,4-dichlorophenyl)-4-(trifluoromethyl)-1H-pyridin-2-one
PubChem CID106517957
Molecular FormulaC12H6Cl2F3NO
Molecular Weight308.09 g/mol
Exact Mass306.98
IUPAC Name6-(2,4-dichlorophenyl)-4-(trifluoromethyl)-1H-pyridin-2-one
SMILESO=c1cc(C(F)(F)F)cc(-c2ccc(Cl)cc2Cl)[nH]1
InChIInChI=1S/C12H6Cl2F3NO/c13-7-1-2-8(9(14)5-7)10-3-6(12(15,16)17)4-11(19)18-10/h1-5H,(H,18,19)
InChIKeyULIWVWRJAVPZHT-UHFFFAOYSA-N
XLogP4.37
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.09
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

6-(4-Chlorophenyl)-2-oxo-4-(trifluoromethyl)-1,2-dihydro-3-pyridinecarbonitrile
CID 1477185
6-(2-Chlorophenyl)-2-hydroxy-4-(trifluoromethyl)nicotinonitrile
CID 1477183
1-(2,6-Dichlorobenzyl)-2-oxo-6-(trifluoromethyl)-1,2-dihydro-3-pyridinecarboxamide
CID 3551766
5-(2,4-Dichlorobenzyl)-4,6-dimethyl-2-pyridinol
CID 4538648
(2E)-3-(2,4-dichlorophenyl)-N-(2-fluorophenyl)prop-2-enamide
CID 700919
6-(3-Chlorophenyl)-2-hydroxy-4-(trifluoromethyl)nicotinonitrile
CID 1477184
(E)-3-(2,4-dichlorophenyl)-N-phenylprop-2-enamide
CID 2598628
2(1H)-Pyridinone, 4-(4-chlorophenyl)-6-phenyl-
CID 724622
4-(4-chloro-phenyl)-6-trifluoromethyl-1H-pyridin-2-one
CID 57468634
N-[1-(2,6-dichlorobenzyl)-2-oxo-1,2-dihydro-3-pyridinyl]-2,2,2-trifluoroacetamide
CID 4594130
N-[(E)-1-(2-chlorophenyl)-3,3,3-trifluoroprop-1-enyl]acetamide
CID 135071135
N-(1-(4-Chlorophenyl)vinyl)acetamide
CID 11159894

Frequently Asked Questions

What is the IUPAC name of 6-(2,4-dichlorophenyl)-4-(trifluoromethyl)-1H-pyridin-2-one?
The IUPAC name of 6-(2,4-dichlorophenyl)-4-(trifluoromethyl)-1H-pyridin-2-one (CID 106517957) is 6-(2,4-dichlorophenyl)-4-(trifluoromethyl)-1H-pyridin-2-one.
What is the SMILES notation for 6-(2,4-dichlorophenyl)-4-(trifluoromethyl)-1H-pyridin-2-one?
The canonical SMILES for 6-(2,4-dichlorophenyl)-4-(trifluoromethyl)-1H-pyridin-2-one is O=c1cc(C(F)(F)F)cc(-c2ccc(Cl)cc2Cl)[nH]1.
What is the InChIKey of 6-(2,4-dichlorophenyl)-4-(trifluoromethyl)-1H-pyridin-2-one?
The InChIKey is ULIWVWRJAVPZHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H6Cl2F3NO/c13-7-1-2-8(9(14)5-7)10-3-6(12(15,16)17)4-11(19)18-10/h1-5H,(H,18,19).
What are the key properties of 6-(2,4-dichlorophenyl)-4-(trifluoromethyl)-1H-pyridin-2-one?
6-(2,4-dichlorophenyl)-4-(trifluoromethyl)-1H-pyridin-2-one has a molecular weight of 308.09 g/mol, XLogP of 4.37, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,4-dichlorophenyl)-4-(trifluoromethyl)-1H-pyridin-2-one is sourced from PubChem (CID 106517957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).