2-(4-bromo-2-fluorophenoxy)-5-chloro-3-fluoropyridine

C11H5BrClF2NO — CID 79727302

IUPAC2-(4-bromo-2-fluorophenoxy)-5-chloro-3-fluoropyridine
SMILESFc1cc(Br)ccc1Oc1ncc(Cl)cc1F
InChIInChI=1S/C11H5BrClF2NO/c12-6-1-2-10(8(14)3-6)17-11-9(15)4-7(13)5-16-11/h1-5H
InChIKeyUEVZJWBYTNFMGH-UHFFFAOYSA-N
MW320.52 g/mol
LogP4.57
Rot. Bonds2

About 2-(4-bromo-2-fluorophenoxy)-5-chloro-3-fluoropyridine

2-(4-bromo-2-fluorophenoxy)-5-chloro-3-fluoropyridine (PubChem CID 79727302) has the molecular formula C11H5BrClF2NO and a molecular weight of 320.52 g/mol. Its IUPAC name is 2-(4-bromo-2-fluorophenoxy)-5-chloro-3-fluoropyridine.

Molecular Properties

Compound Name2-(4-bromo-2-fluorophenoxy)-5-chloro-3-fluoropyridine
PubChem CID79727302
Molecular FormulaC11H5BrClF2NO
Molecular Weight320.52 g/mol
Exact Mass318.92
IUPAC Name2-(4-bromo-2-fluorophenoxy)-5-chloro-3-fluoropyridine
SMILESFc1cc(Br)ccc1Oc1ncc(Cl)cc1F
InChIInChI=1S/C11H5BrClF2NO/c12-6-1-2-10(8(14)3-6)17-11-9(15)4-7(13)5-16-11/h1-5H
InChIKeyUEVZJWBYTNFMGH-UHFFFAOYSA-N
XLogP4.57
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.52
LogP ≤ 54.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-bromo-2-fluorophenoxy)-5-chloro-3-fluoropyridine?
The IUPAC name of 2-(4-bromo-2-fluorophenoxy)-5-chloro-3-fluoropyridine (CID 79727302) is 2-(4-bromo-2-fluorophenoxy)-5-chloro-3-fluoropyridine.
What is the SMILES notation for 2-(4-bromo-2-fluorophenoxy)-5-chloro-3-fluoropyridine?
The canonical SMILES for 2-(4-bromo-2-fluorophenoxy)-5-chloro-3-fluoropyridine is Fc1cc(Br)ccc1Oc1ncc(Cl)cc1F.
What is the InChIKey of 2-(4-bromo-2-fluorophenoxy)-5-chloro-3-fluoropyridine?
The InChIKey is UEVZJWBYTNFMGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H5BrClF2NO/c12-6-1-2-10(8(14)3-6)17-11-9(15)4-7(13)5-16-11/h1-5H.
What are the key properties of 2-(4-bromo-2-fluorophenoxy)-5-chloro-3-fluoropyridine?
2-(4-bromo-2-fluorophenoxy)-5-chloro-3-fluoropyridine has a molecular weight of 320.52 g/mol, XLogP of 4.57, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromo-2-fluorophenoxy)-5-chloro-3-fluoropyridine is sourced from PubChem (CID 79727302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).