5-bromo-6-(2-bromo-5-fluorophenoxy)pyrimidin-4-amine

C10H6Br2FN3O — CID 114073540

IUPAC5-bromo-6-(2-bromo-5-fluorophenoxy)pyrimidin-4-amine
SMILESNc1ncnc(Oc2cc(F)ccc2Br)c1Br
InChIInChI=1S/C10H6Br2FN3O/c11-6-2-1-5(13)3-7(6)17-10-8(12)9(14)15-4-16-10/h1-4H,(H2,14,15,16)
InChIKeyPRXFPJSPASGGFN-UHFFFAOYSA-N
MW362.98 g/mol
LogP3.52
Rot. Bonds2

About 5-bromo-6-(2-bromo-5-fluorophenoxy)pyrimidin-4-amine

5-bromo-6-(2-bromo-5-fluorophenoxy)pyrimidin-4-amine (PubChem CID 114073540) has the molecular formula C10H6Br2FN3O and a molecular weight of 362.98 g/mol. Its IUPAC name is 5-bromo-6-(2-bromo-5-fluorophenoxy)pyrimidin-4-amine.

Molecular Properties

Compound Name5-bromo-6-(2-bromo-5-fluorophenoxy)pyrimidin-4-amine
PubChem CID114073540
Molecular FormulaC10H6Br2FN3O
Molecular Weight362.98 g/mol
Exact Mass360.89
IUPAC Name5-bromo-6-(2-bromo-5-fluorophenoxy)pyrimidin-4-amine
SMILESNc1ncnc(Oc2cc(F)ccc2Br)c1Br
InChIInChI=1S/C10H6Br2FN3O/c11-6-2-1-5(13)3-7(6)17-10-8(12)9(14)15-4-16-10/h1-4H,(H2,14,15,16)
InChIKeyPRXFPJSPASGGFN-UHFFFAOYSA-N
XLogP3.52
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.98
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-bromo-6-(2-bromo-5-fluorophenoxy)pyrimidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-bromo-6-(2,4-difluorophenoxy)pyrimidin-4-amine
CID 114073133
5-bromo-6-(3-bromo-5-fluorophenoxy)pyrimidin-4-amine
CID 114073529
4-(2-bromo-5-fluorophenoxy)pyrimidine-5-carbothioamide
CID 112755595
5-bromo-6-(4-methylsulfanylphenoxy)pyrimidin-4-amine
CID 114073419
4-(6-amino-5-bromopyrimidin-4-yl)oxy-2-fluorobenzonitrile
CID 114073522
[2-(2-bromo-5-fluorophenoxy)-5-fluoro-3-pyridinyl]methanol
CID 114034713
1-bromo-4-fluoro-2-[(2-methylpropan-2-yl)oxy]benzene
CID 101467707
6-(2-bromo-5-nitrophenoxy)-5-methylpyrimidin-4-amine
CID 103013798
4-(2-bromo-5-fluorophenoxy)-5-iodo-1H-pyrimidin-6-one
CID 114574415
4-(2-bromo-5-fluorophenoxy)-2-chloro-5-methylpyridine
CID 83267100
4-(2-bromo-5-fluorophenoxy)-3-methyl-1-(2-methylpropyl)pyrazole
CID 156891420
2-(2-bromo-5-fluorophenoxy)-5-nitropyridine-3-carboxylic acid
CID 104629517

Frequently Asked Questions

What is the IUPAC name of 5-bromo-6-(2-bromo-5-fluorophenoxy)pyrimidin-4-amine?
The IUPAC name of 5-bromo-6-(2-bromo-5-fluorophenoxy)pyrimidin-4-amine (CID 114073540) is 5-bromo-6-(2-bromo-5-fluorophenoxy)pyrimidin-4-amine.
What is the SMILES notation for 5-bromo-6-(2-bromo-5-fluorophenoxy)pyrimidin-4-amine?
The canonical SMILES for 5-bromo-6-(2-bromo-5-fluorophenoxy)pyrimidin-4-amine is Nc1ncnc(Oc2cc(F)ccc2Br)c1Br.
What is the InChIKey of 5-bromo-6-(2-bromo-5-fluorophenoxy)pyrimidin-4-amine?
The InChIKey is PRXFPJSPASGGFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6Br2FN3O/c11-6-2-1-5(13)3-7(6)17-10-8(12)9(14)15-4-16-10/h1-4H,(H2,14,15,16).
What are the key properties of 5-bromo-6-(2-bromo-5-fluorophenoxy)pyrimidin-4-amine?
5-bromo-6-(2-bromo-5-fluorophenoxy)pyrimidin-4-amine has a molecular weight of 362.98 g/mol, XLogP of 3.52, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-6-(2-bromo-5-fluorophenoxy)pyrimidin-4-amine is sourced from PubChem (CID 114073540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).