3-bromo-5-chloro-N-(2,4-dichlorophenyl)pyridin-2-amine

C11H6BrCl3N2 — CID 114836558

IUPAC3-bromo-5-chloro-N-(2,4-dichlorophenyl)pyridin-2-amine
SMILESClc1ccc(Nc2ncc(Cl)cc2Br)c(Cl)c1
InChIInChI=1S/C11H6BrCl3N2/c12-8-3-7(14)5-16-11(8)17-10-2-1-6(13)4-9(10)15/h1-5H,(H,16,17)
InChIKeyXWJJINGCZPDXGM-UHFFFAOYSA-N
MW352.45 g/mol
LogP5.55
Rot. Bonds2

About 3-bromo-5-chloro-N-(2,4-dichlorophenyl)pyridin-2-amine

3-bromo-5-chloro-N-(2,4-dichlorophenyl)pyridin-2-amine (PubChem CID 114836558) has the molecular formula C11H6BrCl3N2 and a molecular weight of 352.45 g/mol. Its IUPAC name is 3-bromo-5-chloro-N-(2,4-dichlorophenyl)pyridin-2-amine.

Molecular Properties

Compound Name3-bromo-5-chloro-N-(2,4-dichlorophenyl)pyridin-2-amine
PubChem CID114836558
Molecular FormulaC11H6BrCl3N2
Molecular Weight352.45 g/mol
Exact Mass349.88
IUPAC Name3-bromo-5-chloro-N-(2,4-dichlorophenyl)pyridin-2-amine
SMILESClc1ccc(Nc2ncc(Cl)cc2Br)c(Cl)c1
InChIInChI=1S/C11H6BrCl3N2/c12-8-3-7(14)5-16-11(8)17-10-2-1-6(13)4-9(10)15/h1-5H,(H,16,17)
InChIKeyXWJJINGCZPDXGM-UHFFFAOYSA-N
XLogP5.55
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500352.45
LogP ≤ 55.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-bromo-N-(2-bromo-4-chlorophenyl)-3-chloropyridin-2-amine
CID 103583411
5-bromo-4-N-(2,4-dichlorophenyl)-2-N-methylpyrimidine-2,4-diamine
CID 80759983
3-bromo-N-(3-bromo-2-methylphenyl)-5-chloropyridin-2-amine
CID 107638006
3-bromo-5-chloro-N-(3-chloro-4-methylphenyl)pyridin-2-amine
CID 114836581
3-bromo-5-chloro-N-(2-chloro-6-fluorophenyl)pyridin-2-amine
CID 114837428
3-bromo-5-chloro-N-(4-methyl-3-pyridinyl)pyridin-2-amine
CID 114837095
3-bromo-5-chloro-N-(2,4-dimethoxyphenyl)pyridin-2-amine
CID 114836602
3-bromo-5-chloro-N-(3,5-difluorophenyl)pyridin-2-amine
CID 114836633
3-bromo-5-chloro-N-thiophen-3-ylpyridin-2-amine
CID 114837216
3-N-(3-bromo-5-chloro-2-pyridinyl)benzene-1,3-diamine
CID 114835563
N-[4-(2-aminoethyl)phenyl]-3-bromo-5-chloropyridin-2-amine
CID 114838670
3-bromo-N-(2-chloro-4-iodophenyl)-5-methylpyridin-2-amine
CID 107607834

Frequently Asked Questions

What is the IUPAC name of 3-bromo-5-chloro-N-(2,4-dichlorophenyl)pyridin-2-amine?
The IUPAC name of 3-bromo-5-chloro-N-(2,4-dichlorophenyl)pyridin-2-amine (CID 114836558) is 3-bromo-5-chloro-N-(2,4-dichlorophenyl)pyridin-2-amine.
What is the SMILES notation for 3-bromo-5-chloro-N-(2,4-dichlorophenyl)pyridin-2-amine?
The canonical SMILES for 3-bromo-5-chloro-N-(2,4-dichlorophenyl)pyridin-2-amine is Clc1ccc(Nc2ncc(Cl)cc2Br)c(Cl)c1.
What is the InChIKey of 3-bromo-5-chloro-N-(2,4-dichlorophenyl)pyridin-2-amine?
The InChIKey is XWJJINGCZPDXGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6BrCl3N2/c12-8-3-7(14)5-16-11(8)17-10-2-1-6(13)4-9(10)15/h1-5H,(H,16,17).
What are the key properties of 3-bromo-5-chloro-N-(2,4-dichlorophenyl)pyridin-2-amine?
3-bromo-5-chloro-N-(2,4-dichlorophenyl)pyridin-2-amine has a molecular weight of 352.45 g/mol, XLogP of 5.55, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-5-chloro-N-(2,4-dichlorophenyl)pyridin-2-amine is sourced from PubChem (CID 114836558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).