2-(4-azidophenoxy)-5-chloro-3-fluoropyridine

C11H6ClFN4O — CID 151314328

IUPAC2-(4-azidophenoxy)-5-chloro-3-fluoropyridine
SMILES[N-]=[N+]=Nc1ccc(Oc2ncc(Cl)cc2F)cc1
InChIInChI=1S/C11H6ClFN4O/c12-7-5-10(13)11(15-6-7)18-9-3-1-8(2-4-9)16-17-14/h1-6H
InChIKeyOFCBSPCZJGSAEW-UHFFFAOYSA-N
MW264.65 g/mol
LogP4.61
Rot. Bonds3

About 2-(4-azidophenoxy)-5-chloro-3-fluoropyridine

2-(4-azidophenoxy)-5-chloro-3-fluoropyridine (PubChem CID 151314328) has the molecular formula C11H6ClFN4O and a molecular weight of 264.65 g/mol. Its IUPAC name is 2-(4-azidophenoxy)-5-chloro-3-fluoropyridine.

Molecular Properties

Compound Name2-(4-azidophenoxy)-5-chloro-3-fluoropyridine
PubChem CID151314328
Molecular FormulaC11H6ClFN4O
Molecular Weight264.65 g/mol
Exact Mass264.02
IUPAC Name2-(4-azidophenoxy)-5-chloro-3-fluoropyridine
SMILES[N-]=[N+]=Nc1ccc(Oc2ncc(Cl)cc2F)cc1
InChIInChI=1S/C11H6ClFN4O/c12-7-5-10(13)11(15-6-7)18-9-3-1-8(2-4-9)16-17-14/h1-6H
InChIKeyOFCBSPCZJGSAEW-UHFFFAOYSA-N
XLogP4.61
TPSA70.88 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.65
LogP ≤ 54.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', '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-azidophenoxy)-5-chloro-3-fluoropyridine?
The IUPAC name of 2-(4-azidophenoxy)-5-chloro-3-fluoropyridine (CID 151314328) is 2-(4-azidophenoxy)-5-chloro-3-fluoropyridine.
What is the SMILES notation for 2-(4-azidophenoxy)-5-chloro-3-fluoropyridine?
The canonical SMILES for 2-(4-azidophenoxy)-5-chloro-3-fluoropyridine is [N-]=[N+]=Nc1ccc(Oc2ncc(Cl)cc2F)cc1.
What is the InChIKey of 2-(4-azidophenoxy)-5-chloro-3-fluoropyridine?
The InChIKey is OFCBSPCZJGSAEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6ClFN4O/c12-7-5-10(13)11(15-6-7)18-9-3-1-8(2-4-9)16-17-14/h1-6H.
What are the key properties of 2-(4-azidophenoxy)-5-chloro-3-fluoropyridine?
2-(4-azidophenoxy)-5-chloro-3-fluoropyridine has a molecular weight of 264.65 g/mol, XLogP of 4.61, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-azidophenoxy)-5-chloro-3-fluoropyridine is sourced from PubChem (CID 151314328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).