5-bromo-2-(4-fluorophenoxy)pyrimidine

C10H6BrFN2O — CID 4270915

IUPAC5-bromo-2-(4-fluorophenoxy)pyrimidine
SMILESFc1ccc(Oc2ncc(Br)cn2)cc1
InChIInChI=1S/C10H6BrFN2O/c11-7-5-13-10(14-6-7)15-9-3-1-8(12)2-4-9/h1-6H
InChIKeyYNUWXJLUUQKHAJ-UHFFFAOYSA-N
MW269.07 g/mol
LogP3.17
Rot. Bonds2

About 5-bromo-2-(4-fluorophenoxy)pyrimidine

5-bromo-2-(4-fluorophenoxy)pyrimidine (PubChem CID 4270915) has the molecular formula C10H6BrFN2O and a molecular weight of 269.07 g/mol. Its IUPAC name is 5-bromo-2-(4-fluorophenoxy)pyrimidine.

Molecular Properties

Compound Name5-bromo-2-(4-fluorophenoxy)pyrimidine
PubChem CID4270915
Molecular FormulaC10H6BrFN2O
Molecular Weight269.07 g/mol
Exact Mass267.96
IUPAC Name5-bromo-2-(4-fluorophenoxy)pyrimidine
SMILESFc1ccc(Oc2ncc(Br)cn2)cc1
InChIInChI=1S/C10H6BrFN2O/c11-7-5-13-10(14-6-7)15-9-3-1-8(12)2-4-9/h1-6H
InChIKeyYNUWXJLUUQKHAJ-UHFFFAOYSA-N
XLogP3.17
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.07
LogP ≤ 53.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-fluorophenoxy)-5-iodopyrimidine
CID 104839781
5-bromo-2-(4-ethoxyphenoxy)pyrimidine
CID 63867392
5-bromo-3-chloro-2-(4-fluorophenoxy)pyridine
CID 103583572
5-bromo-2-[(1S)-1-(4-fluorophenoxy)ethyl]pyrimidine
CID 124729254
2-(4-tert-butylphenoxy)-5-fluoropyrimidine
CID 69192673
2-[(5-bromo-3-pyridinyl)oxy]-4-(4-fluorophenoxy)pyrimidine
CID 133315863
2-(1,3-benzodioxol-5-yloxy)-5-bromopyrimidine
CID 63868415
2-(5-bromopyrimidin-2-yl)oxy-6-fluorobenzonitrile
CID 63867087
6-(5-bromopyrimidin-2-yl)oxy-3,4-dihydro-1H-quinolin-2-one
CID 63867081
6-[2-(4-fluorophenoxy)pyrimidin-5-yl]-[1,2,4]triazolo[1,5-a]pyridine
CID 162507375
2-(3-bromo-4-fluorophenoxy)-5-iodopyrimidine
CID 104844305
5-bromo-6-(4-fluorophenoxy)pyridin-3-amine
CID 79534662

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-(4-fluorophenoxy)pyrimidine?
The IUPAC name of 5-bromo-2-(4-fluorophenoxy)pyrimidine (CID 4270915) is 5-bromo-2-(4-fluorophenoxy)pyrimidine.
What is the SMILES notation for 5-bromo-2-(4-fluorophenoxy)pyrimidine?
The canonical SMILES for 5-bromo-2-(4-fluorophenoxy)pyrimidine is Fc1ccc(Oc2ncc(Br)cn2)cc1.
What is the InChIKey of 5-bromo-2-(4-fluorophenoxy)pyrimidine?
The InChIKey is YNUWXJLUUQKHAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6BrFN2O/c11-7-5-13-10(14-6-7)15-9-3-1-8(12)2-4-9/h1-6H.
What are the key properties of 5-bromo-2-(4-fluorophenoxy)pyrimidine?
5-bromo-2-(4-fluorophenoxy)pyrimidine has a molecular weight of 269.07 g/mol, XLogP of 3.17, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-(4-fluorophenoxy)pyrimidine is sourced from PubChem (CID 4270915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).