2,3,5,6-tetrachloro-N-(4-chlorophenyl)pyridin-4-amine

C11H5Cl5N2 — CID 91252830

IUPAC2,3,5,6-tetrachloro-N-(4-chlorophenyl)pyridin-4-amine
SMILESClc1ccc(Nc2c(Cl)c(Cl)nc(Cl)c2Cl)cc1
InChIInChI=1S/C11H5Cl5N2/c12-5-1-3-6(4-2-5)17-9-7(13)10(15)18-11(16)8(9)14/h1-4H,(H,17,18)
InChIKeyUYEANUFNROPMDU-UHFFFAOYSA-N
MW342.44 g/mol
LogP6.09
Rot. Bonds2

About 2,3,5,6-tetrachloro-N-(4-chlorophenyl)pyridin-4-amine

2,3,5,6-tetrachloro-N-(4-chlorophenyl)pyridin-4-amine (PubChem CID 91252830) has the molecular formula C11H5Cl5N2 and a molecular weight of 342.44 g/mol. Its IUPAC name is 2,3,5,6-tetrachloro-N-(4-chlorophenyl)pyridin-4-amine.

Molecular Properties

Compound Name2,3,5,6-tetrachloro-N-(4-chlorophenyl)pyridin-4-amine
PubChem CID91252830
Molecular FormulaC11H5Cl5N2
Molecular Weight342.44 g/mol
Exact Mass339.89
IUPAC Name2,3,5,6-tetrachloro-N-(4-chlorophenyl)pyridin-4-amine
SMILESClc1ccc(Nc2c(Cl)c(Cl)nc(Cl)c2Cl)cc1
InChIInChI=1S/C11H5Cl5N2/c12-5-1-3-6(4-2-5)17-9-7(13)10(15)18-11(16)8(9)14/h1-4H,(H,17,18)
InChIKeyUYEANUFNROPMDU-UHFFFAOYSA-N
XLogP6.09
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500342.44
LogP ≤ 56.09
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

N-(4-chlorophenyl)-2,6-dimethylaniline
CID 10977319
4-anilino-3,5,6-trichloropyridine-2-carbonitrile
CID 166798381
sodium;9-chloroacridine;bis(N-(4-chlorophenyl)acridin-9-amine);hydroxide;hydrochloride
CID 160972351
2,4,5,6-tetrachloro-N-(4-chlorophenyl)pyridine-3-carboxamide
CID 4656022
methyl 4-anilino-3,5,6-trichloropyridine-2-carboxylate
CID 166798314
6-chloro-N-(4-chlorophenyl)-3-fluoropyridin-2-amine
CID 90134265
1-N,2-N-bis(4-chlorophenyl)benzene-1,2-diamine
CID 22968513
5-chloro-N-(4-chlorophenyl)-[1,2,5]oxadiazolo[3,4-b]pyrazin-6-amine
CID 911346
5-(4-chloroanilino)-6-methyl-1H-pyrimidine-2,4-dione
CID 121223589
N-(4-chlorophenyl)-10,15,20-triphenyl-21,23-dihydroporphyrin-5-amine
CID 135909496
2-N-(4-chlorophenyl)-4-N-(2,6-dichlorophenyl)pyrimidine-2,4-diamine
CID 112903842
5-(4-chlorophenyl)-4-N-(4-methylphenyl)-1H-pyrazole-3,4-diamine
CID 56979538

Frequently Asked Questions

What is the IUPAC name of 2,3,5,6-tetrachloro-N-(4-chlorophenyl)pyridin-4-amine?
The IUPAC name of 2,3,5,6-tetrachloro-N-(4-chlorophenyl)pyridin-4-amine (CID 91252830) is 2,3,5,6-tetrachloro-N-(4-chlorophenyl)pyridin-4-amine.
What is the SMILES notation for 2,3,5,6-tetrachloro-N-(4-chlorophenyl)pyridin-4-amine?
The canonical SMILES for 2,3,5,6-tetrachloro-N-(4-chlorophenyl)pyridin-4-amine is Clc1ccc(Nc2c(Cl)c(Cl)nc(Cl)c2Cl)cc1.
What is the InChIKey of 2,3,5,6-tetrachloro-N-(4-chlorophenyl)pyridin-4-amine?
The InChIKey is UYEANUFNROPMDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H5Cl5N2/c12-5-1-3-6(4-2-5)17-9-7(13)10(15)18-11(16)8(9)14/h1-4H,(H,17,18).
What are the key properties of 2,3,5,6-tetrachloro-N-(4-chlorophenyl)pyridin-4-amine?
2,3,5,6-tetrachloro-N-(4-chlorophenyl)pyridin-4-amine has a molecular weight of 342.44 g/mol, XLogP of 6.09, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,5,6-tetrachloro-N-(4-chlorophenyl)pyridin-4-amine is sourced from PubChem (CID 91252830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).