2-bromo-5-(6-chloro-3-pyridinyl)pyridine

C10H6BrClN2 — CID 42553023

IUPAC2-bromo-5-(6-chloro-3-pyridinyl)pyridine
SMILESClc1ccc(-c2ccc(Br)nc2)cn1
InChIInChI=1S/C10H6BrClN2/c11-9-3-1-7(5-13-9)8-2-4-10(12)14-6-8/h1-6H
InChIKeyVHZRDSCPWVOYIE-UHFFFAOYSA-N
MW269.53 g/mol
LogP3.56
Rot. Bonds1

About 2-bromo-5-(6-chloro-3-pyridinyl)pyridine

2-bromo-5-(6-chloro-3-pyridinyl)pyridine (PubChem CID 42553023) has the molecular formula C10H6BrClN2 and a molecular weight of 269.53 g/mol. Its IUPAC name is 2-bromo-5-(6-chloro-3-pyridinyl)pyridine.

Molecular Properties

Compound Name2-bromo-5-(6-chloro-3-pyridinyl)pyridine
PubChem CID42553023
Molecular FormulaC10H6BrClN2
Molecular Weight269.53 g/mol
Exact Mass267.94
IUPAC Name2-bromo-5-(6-chloro-3-pyridinyl)pyridine
SMILESClc1ccc(-c2ccc(Br)nc2)cn1
InChIInChI=1S/C10H6BrClN2/c11-9-3-1-7(5-13-9)8-2-4-10(12)14-6-8/h1-6H
InChIKeyVHZRDSCPWVOYIE-UHFFFAOYSA-N
XLogP3.56
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.53
LogP ≤ 53.56
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 2-bromo-5-(6-chloro-3-pyridinyl)pyridine?
The IUPAC name of 2-bromo-5-(6-chloro-3-pyridinyl)pyridine (CID 42553023) is 2-bromo-5-(6-chloro-3-pyridinyl)pyridine.
What is the SMILES notation for 2-bromo-5-(6-chloro-3-pyridinyl)pyridine?
The canonical SMILES for 2-bromo-5-(6-chloro-3-pyridinyl)pyridine is Clc1ccc(-c2ccc(Br)nc2)cn1.
What is the InChIKey of 2-bromo-5-(6-chloro-3-pyridinyl)pyridine?
The InChIKey is VHZRDSCPWVOYIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6BrClN2/c11-9-3-1-7(5-13-9)8-2-4-10(12)14-6-8/h1-6H.
What are the key properties of 2-bromo-5-(6-chloro-3-pyridinyl)pyridine?
2-bromo-5-(6-chloro-3-pyridinyl)pyridine has a molecular weight of 269.53 g/mol, XLogP of 3.56, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-5-(6-chloro-3-pyridinyl)pyridine is sourced from PubChem (CID 42553023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).