5-bromo-2-(2-bromo-5-chlorophenyl)-6-methylpyrimidin-4-amine

C11H8Br2ClN3 — CID 66303833

IUPAC5-bromo-2-(2-bromo-5-chlorophenyl)-6-methylpyrimidin-4-amine
SMILESCc1nc(-c2cc(Cl)ccc2Br)nc(N)c1Br
InChIInChI=1S/C11H8Br2ClN3/c1-5-9(13)10(15)17-11(16-5)7-4-6(14)2-3-8(7)12/h2-4H,1H3,(H2,15,16,17)
InChIKeyOQIPPHAJJUITHG-UHFFFAOYSA-N
MW377.47 g/mol
LogP4.21
Rot. Bonds1

About 5-bromo-2-(2-bromo-5-chlorophenyl)-6-methylpyrimidin-4-amine

5-bromo-2-(2-bromo-5-chlorophenyl)-6-methylpyrimidin-4-amine (PubChem CID 66303833) has the molecular formula C11H8Br2ClN3 and a molecular weight of 377.47 g/mol. Its IUPAC name is 5-bromo-2-(2-bromo-5-chlorophenyl)-6-methylpyrimidin-4-amine.

Molecular Properties

Compound Name5-bromo-2-(2-bromo-5-chlorophenyl)-6-methylpyrimidin-4-amine
PubChem CID66303833
Molecular FormulaC11H8Br2ClN3
Molecular Weight377.47 g/mol
Exact Mass374.88
IUPAC Name5-bromo-2-(2-bromo-5-chlorophenyl)-6-methylpyrimidin-4-amine
SMILESCc1nc(-c2cc(Cl)ccc2Br)nc(N)c1Br
InChIInChI=1S/C11H8Br2ClN3/c1-5-9(13)10(15)17-11(16-5)7-4-6(14)2-3-8(7)12/h2-4H,1H3,(H2,15,16,17)
InChIKeyOQIPPHAJJUITHG-UHFFFAOYSA-N
XLogP4.21
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.47
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-bromo-5-chlorophenyl)-6-methylpyrimidin-4-amine
CID 66160132
2-(2-bromo-5-chlorophenyl)-4-chloro-5-iodo-6-methylpyrimidine
CID 66312236
2-(2-bromo-5-chlorophenyl)-4-chloro-5-fluoro-6-methylpyrimidine
CID 66160468
2-(2-bromo-5-fluorophenyl)-5,6-dimethylpyrimidin-4-amine
CID 114016371
2-(2-bromo-5-chlorophenyl)-5-ethyl-N,6-dimethylpyrimidin-4-amine
CID 66160720
5-bromo-6-methyl-2-(2-methylphenyl)pyrimidin-4-amine
CID 66306257
5-bromo-2-(3,4-difluorophenyl)-6-methylpyrimidin-4-amine
CID 66304664
2-(2-bromo-5-chlorophenyl)-N,6-dimethylpyrimidin-4-amine
CID 66160131
2-(2-bromo-5-chlorophenyl)-6-(methoxymethyl)pyrimidin-4-amine
CID 66161513
5-bromo-6-methyl-2-phenylpyrimidin-4-amine
CID 66304858
4-amino-2-(2-bromo-5-fluorophenyl)-6-methylpyrimidine-5-carboxylic acid
CID 107924801
5-bromo-2-(2-bromo-5-chlorophenyl)-N-methyl-6-propylpyrimidin-4-amine
CID 66296525

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-(2-bromo-5-chlorophenyl)-6-methylpyrimidin-4-amine?
The IUPAC name of 5-bromo-2-(2-bromo-5-chlorophenyl)-6-methylpyrimidin-4-amine (CID 66303833) is 5-bromo-2-(2-bromo-5-chlorophenyl)-6-methylpyrimidin-4-amine.
What is the SMILES notation for 5-bromo-2-(2-bromo-5-chlorophenyl)-6-methylpyrimidin-4-amine?
The canonical SMILES for 5-bromo-2-(2-bromo-5-chlorophenyl)-6-methylpyrimidin-4-amine is Cc1nc(-c2cc(Cl)ccc2Br)nc(N)c1Br.
What is the InChIKey of 5-bromo-2-(2-bromo-5-chlorophenyl)-6-methylpyrimidin-4-amine?
The InChIKey is OQIPPHAJJUITHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8Br2ClN3/c1-5-9(13)10(15)17-11(16-5)7-4-6(14)2-3-8(7)12/h2-4H,1H3,(H2,15,16,17).
What are the key properties of 5-bromo-2-(2-bromo-5-chlorophenyl)-6-methylpyrimidin-4-amine?
5-bromo-2-(2-bromo-5-chlorophenyl)-6-methylpyrimidin-4-amine has a molecular weight of 377.47 g/mol, XLogP of 4.21, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-(2-bromo-5-chlorophenyl)-6-methylpyrimidin-4-amine is sourced from PubChem (CID 66303833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).