2-(4-azidophenyl)-6-bromopyridine

C11H7BrN4 — CID 102418495

IUPAC2-(4-azidophenyl)-6-bromopyridine
SMILES[N-]=[N+]=Nc1ccc(-c2cccc(Br)n2)cc1
InChIInChI=1S/C11H7BrN4/c12-11-3-1-2-10(14-11)8-4-6-9(7-5-8)15-16-13/h1-7H
InChIKeyRGIBORVAAXOAQQ-UHFFFAOYSA-N
MW275.11 g/mol
LogP4.45
Rot. Bonds2

About 2-(4-azidophenyl)-6-bromopyridine

2-(4-azidophenyl)-6-bromopyridine (PubChem CID 102418495) has the molecular formula C11H7BrN4 and a molecular weight of 275.11 g/mol. Its IUPAC name is 2-(4-azidophenyl)-6-bromopyridine.

Molecular Properties

Compound Name2-(4-azidophenyl)-6-bromopyridine
PubChem CID102418495
Molecular FormulaC11H7BrN4
Molecular Weight275.11 g/mol
Exact Mass273.99
IUPAC Name2-(4-azidophenyl)-6-bromopyridine
SMILES[N-]=[N+]=Nc1ccc(-c2cccc(Br)n2)cc1
InChIInChI=1S/C11H7BrN4/c12-11-3-1-2-10(14-11)8-4-6-9(7-5-8)15-16-13/h1-7H
InChIKeyRGIBORVAAXOAQQ-UHFFFAOYSA-N
XLogP4.45
TPSA61.65 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.11
LogP ≤ 54.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(4-azidophenyl)-6-bromopyridine?
The IUPAC name of 2-(4-azidophenyl)-6-bromopyridine (CID 102418495) is 2-(4-azidophenyl)-6-bromopyridine.
What is the SMILES notation for 2-(4-azidophenyl)-6-bromopyridine?
The canonical SMILES for 2-(4-azidophenyl)-6-bromopyridine is [N-]=[N+]=Nc1ccc(-c2cccc(Br)n2)cc1.
What is the InChIKey of 2-(4-azidophenyl)-6-bromopyridine?
The InChIKey is RGIBORVAAXOAQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7BrN4/c12-11-3-1-2-10(14-11)8-4-6-9(7-5-8)15-16-13/h1-7H.
What are the key properties of 2-(4-azidophenyl)-6-bromopyridine?
2-(4-azidophenyl)-6-bromopyridine has a molecular weight of 275.11 g/mol, XLogP of 4.45, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-azidophenyl)-6-bromopyridine is sourced from PubChem (CID 102418495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).