6-chloro-N-(2,6-dichlorophenyl)-4-(trifluoromethyl)pyridin-2-amine

C12H6Cl3F3N2 — CID 102715985

IUPAC6-chloro-N-(2,6-dichlorophenyl)-4-(trifluoromethyl)pyridin-2-amine
SMILESFC(F)(F)c1cc(Cl)nc(Nc2c(Cl)cccc2Cl)c1
InChIInChI=1S/C12H6Cl3F3N2/c13-7-2-1-3-8(14)11(7)20-10-5-6(12(16,17)18)4-9(15)19-10/h1-5H,(H,19,20)
InChIKeySRGLXPADGGZBNM-UHFFFAOYSA-N
MW341.55 g/mol
LogP5.80
Rot. Bonds2

About 6-chloro-N-(2,6-dichlorophenyl)-4-(trifluoromethyl)pyridin-2-amine

6-chloro-N-(2,6-dichlorophenyl)-4-(trifluoromethyl)pyridin-2-amine (PubChem CID 102715985) has the molecular formula C12H6Cl3F3N2 and a molecular weight of 341.55 g/mol. Its IUPAC name is 6-chloro-N-(2,6-dichlorophenyl)-4-(trifluoromethyl)pyridin-2-amine.

Molecular Properties

Compound Name6-chloro-N-(2,6-dichlorophenyl)-4-(trifluoromethyl)pyridin-2-amine
PubChem CID102715985
Molecular FormulaC12H6Cl3F3N2
Molecular Weight341.55 g/mol
Exact Mass339.95
IUPAC Name6-chloro-N-(2,6-dichlorophenyl)-4-(trifluoromethyl)pyridin-2-amine
SMILESFC(F)(F)c1cc(Cl)nc(Nc2c(Cl)cccc2Cl)c1
InChIInChI=1S/C12H6Cl3F3N2/c13-7-2-1-3-8(14)11(7)20-10-5-6(12(16,17)18)4-9(15)19-10/h1-5H,(H,19,20)
InChIKeySRGLXPADGGZBNM-UHFFFAOYSA-N
XLogP5.80
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500341.55
LogP ≤ 55.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

6-chloro-N-(2-chloro-6-fluorophenyl)-4-(trifluoromethyl)pyridin-2-amine
CID 102716226
6-chloro-N-(5-chloro-2-fluorophenyl)-4-(trifluoromethyl)pyridin-2-amine
CID 102715497
N-(4-bromo-3-chlorophenyl)-6-chloro-4-(trifluoromethyl)pyridin-2-amine
CID 107615011
4-N-(2,6-dichlorophenyl)-2-(trifluoromethyl)pyrimidine-4,6-diamine
CID 106772319
6-chloro-N-(3,4-dimethylphenyl)-4-(trifluoromethyl)pyridin-2-amine
CID 102715335
2-[[6-chloro-4-(trifluoromethyl)-2-pyridinyl]amino]benzonitrile
CID 102715383
6-chloro-N-(2,4-dibromophenyl)-4-(trifluoromethyl)pyridin-2-amine
CID 102715636
N-(2-bromo-5-fluorophenyl)-6-chloro-4-(trifluoromethyl)pyridin-2-amine
CID 107637179
6-chloro-N-cyclopentyl-4-(trifluoromethyl)pyridin-2-amine
CID 102715432
6-N-(2-chlorophenyl)-4-(trifluoromethyl)pyridine-2,6-diamine
CID 102717101
6-chloro-N-[(3-methylphenyl)methyl]-4-(trifluoromethyl)pyridin-2-amine
CID 102715553
N-(3-chloro-2-methylphenyl)-6-hydrazinyl-4-(trifluoromethyl)pyridin-2-amine
CID 102720917

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(2,6-dichlorophenyl)-4-(trifluoromethyl)pyridin-2-amine?
The IUPAC name of 6-chloro-N-(2,6-dichlorophenyl)-4-(trifluoromethyl)pyridin-2-amine (CID 102715985) is 6-chloro-N-(2,6-dichlorophenyl)-4-(trifluoromethyl)pyridin-2-amine.
What is the SMILES notation for 6-chloro-N-(2,6-dichlorophenyl)-4-(trifluoromethyl)pyridin-2-amine?
The canonical SMILES for 6-chloro-N-(2,6-dichlorophenyl)-4-(trifluoromethyl)pyridin-2-amine is FC(F)(F)c1cc(Cl)nc(Nc2c(Cl)cccc2Cl)c1.
What is the InChIKey of 6-chloro-N-(2,6-dichlorophenyl)-4-(trifluoromethyl)pyridin-2-amine?
The InChIKey is SRGLXPADGGZBNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H6Cl3F3N2/c13-7-2-1-3-8(14)11(7)20-10-5-6(12(16,17)18)4-9(15)19-10/h1-5H,(H,19,20).
What are the key properties of 6-chloro-N-(2,6-dichlorophenyl)-4-(trifluoromethyl)pyridin-2-amine?
6-chloro-N-(2,6-dichlorophenyl)-4-(trifluoromethyl)pyridin-2-amine has a molecular weight of 341.55 g/mol, XLogP of 5.80, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(2,6-dichlorophenyl)-4-(trifluoromethyl)pyridin-2-amine is sourced from PubChem (CID 102715985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).