3,6-dichloro-2-(3,6-dichloro-2-pyridinyl)pyridine

C10H4Cl4N2 — CID 135042687

IUPAC3,6-dichloro-2-(3,6-dichloro-2-pyridinyl)pyridine
SMILESClc1ccc(Cl)c(-c2nc(Cl)ccc2Cl)n1
InChIInChI=1S/C10H4Cl4N2/c11-5-1-3-7(13)15-9(5)10-6(12)2-4-8(14)16-10/h1-4H
InChIKeyNZQHLBWOEPVKRY-UHFFFAOYSA-N
MW293.97 g/mol
LogP4.76
Rot. Bonds1

About 3,6-dichloro-2-(3,6-dichloro-2-pyridinyl)pyridine

3,6-dichloro-2-(3,6-dichloro-2-pyridinyl)pyridine (PubChem CID 135042687) has the molecular formula C10H4Cl4N2 and a molecular weight of 293.97 g/mol. Its IUPAC name is 3,6-dichloro-2-(3,6-dichloro-2-pyridinyl)pyridine.

Molecular Properties

Compound Name3,6-dichloro-2-(3,6-dichloro-2-pyridinyl)pyridine
PubChem CID135042687
Molecular FormulaC10H4Cl4N2
Molecular Weight293.97 g/mol
Exact Mass291.91
IUPAC Name3,6-dichloro-2-(3,6-dichloro-2-pyridinyl)pyridine
SMILESClc1ccc(Cl)c(-c2nc(Cl)ccc2Cl)n1
InChIInChI=1S/C10H4Cl4N2/c11-5-1-3-7(13)15-9(5)10-6(12)2-4-8(14)16-10/h1-4H
InChIKeyNZQHLBWOEPVKRY-UHFFFAOYSA-N
XLogP4.76
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.97
LogP ≤ 54.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3,6-dichloro-2-(3,6-dichloro-2-pyridinyl)pyridine?
The IUPAC name of 3,6-dichloro-2-(3,6-dichloro-2-pyridinyl)pyridine (CID 135042687) is 3,6-dichloro-2-(3,6-dichloro-2-pyridinyl)pyridine.
What is the SMILES notation for 3,6-dichloro-2-(3,6-dichloro-2-pyridinyl)pyridine?
The canonical SMILES for 3,6-dichloro-2-(3,6-dichloro-2-pyridinyl)pyridine is Clc1ccc(Cl)c(-c2nc(Cl)ccc2Cl)n1.
What is the InChIKey of 3,6-dichloro-2-(3,6-dichloro-2-pyridinyl)pyridine?
The InChIKey is NZQHLBWOEPVKRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H4Cl4N2/c11-5-1-3-7(13)15-9(5)10-6(12)2-4-8(14)16-10/h1-4H.
What are the key properties of 3,6-dichloro-2-(3,6-dichloro-2-pyridinyl)pyridine?
3,6-dichloro-2-(3,6-dichloro-2-pyridinyl)pyridine has a molecular weight of 293.97 g/mol, XLogP of 4.76, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-dichloro-2-(3,6-dichloro-2-pyridinyl)pyridine is sourced from PubChem (CID 135042687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).