1-amino-3-(2,4-dichlorophenyl)-6-(trifluoromethyl)pyridin-2-one

C12H7Cl2F3N2O — CID 15457050

IUPAC1-amino-3-(2,4-dichlorophenyl)-6-(trifluoromethyl)pyridin-2-one
SMILESNn1c(C(F)(F)F)ccc(-c2ccc(Cl)cc2Cl)c1=O
InChIInChI=1S/C12H7Cl2F3N2O/c13-6-1-2-7(9(14)5-6)8-3-4-10(12(15,16)17)19(18)11(8)20/h1-5H,18H2
InChIKeyYGWQTKLANLMKLH-UHFFFAOYSA-N
MW323.10 g/mol
LogP3.55
Rot. Bonds1

About 1-amino-3-(2,4-dichlorophenyl)-6-(trifluoromethyl)pyridin-2-one

1-amino-3-(2,4-dichlorophenyl)-6-(trifluoromethyl)pyridin-2-one (PubChem CID 15457050) has the molecular formula C12H7Cl2F3N2O and a molecular weight of 323.10 g/mol. Its IUPAC name is 1-amino-3-(2,4-dichlorophenyl)-6-(trifluoromethyl)pyridin-2-one.

Molecular Properties

Compound Name1-amino-3-(2,4-dichlorophenyl)-6-(trifluoromethyl)pyridin-2-one
PubChem CID15457050
Molecular FormulaC12H7Cl2F3N2O
Molecular Weight323.10 g/mol
Exact Mass321.99
IUPAC Name1-amino-3-(2,4-dichlorophenyl)-6-(trifluoromethyl)pyridin-2-one
SMILESNn1c(C(F)(F)F)ccc(-c2ccc(Cl)cc2Cl)c1=O
InChIInChI=1S/C12H7Cl2F3N2O/c13-6-1-2-7(9(14)5-6)8-3-4-10(12(15,16)17)19(18)11(8)20/h1-5H,18H2
InChIKeyYGWQTKLANLMKLH-UHFFFAOYSA-N
XLogP3.55
TPSA48.02 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.10
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-amino-3-(2,4-dichlorophenyl)-6-(trifluoromethyl)pyridin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,4-dichloro-N-(4,6-dimethyl-2-oxopyridin-1(2H)-yl)benzamide
CID 4862793
3-(2,4-dichlorophenyl)-1-difluoromethyl-6-methyl-2(1H)-pyridone
CID 15457049
3-(2,4-dichlorophenyl)-6-trifluoromethyl-2(1H)-pyridone
CID 15457186
2,4-dichloro-N-(1,1,1-trifluoropropan-2-yl)benzohydrazide
CID 53687207
2-(2,4-Dichlorophenyl)-1-(trifluoromethyl)-5,6,7,8-tetrahydropyrazolo[1,2-a]pyridazin-3-one
CID 90434435
4-chloro-3-(4-chlorophenyl)-6-(trifluoromethyl)-1H-pyridin-2-one
CID 139797653
4-chloro-3-(4-chloro-2-fluorophenyl)-6-(trifluoromethyl)-1H-pyridin-2-one
CID 139829449
3-(4-chlorophenyl)-4-methyl-6-(trifluoromethyl)-1H-pyridin-2-one
CID 141960708
4-hydroxy-3-(2,4,6-trichlorophenyl)-6-(trifluoromethyl)-1H-pyridin-2-one
CID 119004532
4-[(2,4-Dichlorophenyl)methyl]-5-(trifluoromethyl)-1,2-dihydropyrazol-3-one
CID 132590534
3-(2,4,5-Trichlorophenyl)-6-(trifluoromethyl)pyridin-2(1H)-one
CID 133091410
3-(2,3,4-trichlorophenyl)-6-(trifluoromethyl)-1H-pyridin-2-one
CID 133092420

Frequently Asked Questions

What is the IUPAC name of 1-amino-3-(2,4-dichlorophenyl)-6-(trifluoromethyl)pyridin-2-one?
The IUPAC name of 1-amino-3-(2,4-dichlorophenyl)-6-(trifluoromethyl)pyridin-2-one (CID 15457050) is 1-amino-3-(2,4-dichlorophenyl)-6-(trifluoromethyl)pyridin-2-one.
What is the SMILES notation for 1-amino-3-(2,4-dichlorophenyl)-6-(trifluoromethyl)pyridin-2-one?
The canonical SMILES for 1-amino-3-(2,4-dichlorophenyl)-6-(trifluoromethyl)pyridin-2-one is Nn1c(C(F)(F)F)ccc(-c2ccc(Cl)cc2Cl)c1=O.
What is the InChIKey of 1-amino-3-(2,4-dichlorophenyl)-6-(trifluoromethyl)pyridin-2-one?
The InChIKey is YGWQTKLANLMKLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7Cl2F3N2O/c13-6-1-2-7(9(14)5-6)8-3-4-10(12(15,16)17)19(18)11(8)20/h1-5H,18H2.
What are the key properties of 1-amino-3-(2,4-dichlorophenyl)-6-(trifluoromethyl)pyridin-2-one?
1-amino-3-(2,4-dichlorophenyl)-6-(trifluoromethyl)pyridin-2-one has a molecular weight of 323.10 g/mol, XLogP of 3.55, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-3-(2,4-dichlorophenyl)-6-(trifluoromethyl)pyridin-2-one is sourced from PubChem (CID 15457050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).