6-chloro-2-N-(2,3-dichlorophenyl)pyridine-2,3-diamine

C11H8Cl3N3 — CID 115473651

IUPAC6-chloro-2-N-(2,3-dichlorophenyl)pyridine-2,3-diamine
SMILESNc1ccc(Cl)nc1Nc1cccc(Cl)c1Cl
InChIInChI=1S/C11H8Cl3N3/c12-6-2-1-3-8(10(6)14)16-11-7(15)4-5-9(13)17-11/h1-5H,15H2,(H,16,17)
InChIKeyYZOBKBRFMVKNSF-UHFFFAOYSA-N
MW288.56 g/mol
LogP4.37
Rot. Bonds2

About 6-chloro-2-N-(2,3-dichlorophenyl)pyridine-2,3-diamine

6-chloro-2-N-(2,3-dichlorophenyl)pyridine-2,3-diamine (PubChem CID 115473651) has the molecular formula C11H8Cl3N3 and a molecular weight of 288.56 g/mol. Its IUPAC name is 6-chloro-2-N-(2,3-dichlorophenyl)pyridine-2,3-diamine.

Molecular Properties

Compound Name6-chloro-2-N-(2,3-dichlorophenyl)pyridine-2,3-diamine
PubChem CID115473651
Molecular FormulaC11H8Cl3N3
Molecular Weight288.56 g/mol
Exact Mass286.98
IUPAC Name6-chloro-2-N-(2,3-dichlorophenyl)pyridine-2,3-diamine
SMILESNc1ccc(Cl)nc1Nc1cccc(Cl)c1Cl
InChIInChI=1S/C11H8Cl3N3/c12-6-2-1-3-8(10(6)14)16-11-7(15)4-5-9(13)17-11/h1-5H,15H2,(H,16,17)
InChIKeyYZOBKBRFMVKNSF-UHFFFAOYSA-N
XLogP4.37
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.56
LogP ≤ 54.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-N-(2,3-dichlorophenyl)-6-methoxypyridine-2,3-diamine
CID 115320367
6-chloro-2-N-(2-iodophenyl)pyridine-2,3-diamine
CID 115473632
6-chloro-2-N-isoquinolin-8-ylpyridine-2,3-diamine
CID 115474338
4-N-(2,3-dichlorophenyl)quinazoline-2,4-diamine
CID 80755119
4-N-(2,3-dichlorophenyl)benzene-1,2,4-triamine
CID 106750347
6-chloro-2-N-(5-chloroquinolin-8-yl)pyridine-2,3-diamine
CID 116783040
4-N-(2,3-dichlorophenyl)-5-fluoropyrimidine-2,4-diamine
CID 80755046
6-chloro-2-N-pyridin-2-ylpyridine-2,3-diamine
CID 53486868
6-chloro-2-N-(2,4-difluorophenyl)pyridine-2,3-diamine
CID 113316733
6-chloro-2-N-(2,6-dichloro-4-fluorophenyl)pyridine-2,3-diamine
CID 83076459
3,5-dichloro-6-N-(2,3-dichlorophenyl)-2-N-methylpyridine-2,6-diamine
CID 102754522
4-bromo-2-N-(2,3-dichlorophenyl)benzene-1,2-diamine
CID 65343667

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-N-(2,3-dichlorophenyl)pyridine-2,3-diamine?
The IUPAC name of 6-chloro-2-N-(2,3-dichlorophenyl)pyridine-2,3-diamine (CID 115473651) is 6-chloro-2-N-(2,3-dichlorophenyl)pyridine-2,3-diamine.
What is the SMILES notation for 6-chloro-2-N-(2,3-dichlorophenyl)pyridine-2,3-diamine?
The canonical SMILES for 6-chloro-2-N-(2,3-dichlorophenyl)pyridine-2,3-diamine is Nc1ccc(Cl)nc1Nc1cccc(Cl)c1Cl.
What is the InChIKey of 6-chloro-2-N-(2,3-dichlorophenyl)pyridine-2,3-diamine?
The InChIKey is YZOBKBRFMVKNSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8Cl3N3/c12-6-2-1-3-8(10(6)14)16-11-7(15)4-5-9(13)17-11/h1-5H,15H2,(H,16,17).
What are the key properties of 6-chloro-2-N-(2,3-dichlorophenyl)pyridine-2,3-diamine?
6-chloro-2-N-(2,3-dichlorophenyl)pyridine-2,3-diamine has a molecular weight of 288.56 g/mol, XLogP of 4.37, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-N-(2,3-dichlorophenyl)pyridine-2,3-diamine is sourced from PubChem (CID 115473651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).