5-bromo-4,6-dichloro-2-(5-fluoro-2-methylphenyl)pyrimidine

C11H6BrCl2FN2 — CID 66314548

IUPAC5-bromo-4,6-dichloro-2-(5-fluoro-2-methylphenyl)pyrimidine
SMILESCc1ccc(F)cc1-c1nc(Cl)c(Br)c(Cl)n1
InChIInChI=1S/C11H6BrCl2FN2/c1-5-2-3-6(15)4-7(5)11-16-9(13)8(12)10(14)17-11/h2-4H,1H3
InChIKeyQMNAKAVFXDTIGZ-UHFFFAOYSA-N
MW335.99 g/mol
LogP4.66
Rot. Bonds1

About 5-bromo-4,6-dichloro-2-(5-fluoro-2-methylphenyl)pyrimidine

5-bromo-4,6-dichloro-2-(5-fluoro-2-methylphenyl)pyrimidine (PubChem CID 66314548) has the molecular formula C11H6BrCl2FN2 and a molecular weight of 335.99 g/mol. Its IUPAC name is 5-bromo-4,6-dichloro-2-(5-fluoro-2-methylphenyl)pyrimidine.

Molecular Properties

Compound Name5-bromo-4,6-dichloro-2-(5-fluoro-2-methylphenyl)pyrimidine
PubChem CID66314548
Molecular FormulaC11H6BrCl2FN2
Molecular Weight335.99 g/mol
Exact Mass333.91
IUPAC Name5-bromo-4,6-dichloro-2-(5-fluoro-2-methylphenyl)pyrimidine
SMILESCc1ccc(F)cc1-c1nc(Cl)c(Br)c(Cl)n1
InChIInChI=1S/C11H6BrCl2FN2/c1-5-2-3-6(15)4-7(5)11-16-9(13)8(12)10(14)17-11/h2-4H,1H3
InChIKeyQMNAKAVFXDTIGZ-UHFFFAOYSA-N
XLogP4.66
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.99
LogP ≤ 54.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-chloro-6-fluoro-2-(5-fluoro-2-methylphenyl)quinazoline
CID 63085513
4-chloro-2-(5-fluoro-2-methylphenyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine
CID 62387415
4-chloro-2-(5-fluoro-2-methylphenyl)-6-methylpyrimidine
CID 62387743
4-chloro-2-(5-fluoro-2-methylphenyl)-8-methylquinazoline
CID 63084485
5-bromo-2-(5-fluoro-2-methylphenyl)-N,6-dimethylpyrimidin-4-amine
CID 66304873
5-bromo-4-chloro-2-(2,5-dimethylphenyl)-6-ethylpyrimidine
CID 66313424
2-(5-fluoro-2-methylphenyl)-6-methylpyrimidin-4-amine
CID 55208923
2-(5-fluoro-2-methylphenyl)-5,6-dimethylpyrimidin-4-amine
CID 55067572
2-(5-chloro-2-methylphenyl)-4-fluoro-1-methylbenzene
CID 129059245
6-bromo-2-(5-fluoro-2-methylphenyl)quinazolin-4-amine
CID 64983352
4-chloro-7-fluoro-2-(2-methylphenyl)quinazoline
CID 63083992
2-(2-bromo-5-fluorophenyl)-4,6-dichloro-5-propylpyrimidine
CID 107923785

Frequently Asked Questions

What is the IUPAC name of 5-bromo-4,6-dichloro-2-(5-fluoro-2-methylphenyl)pyrimidine?
The IUPAC name of 5-bromo-4,6-dichloro-2-(5-fluoro-2-methylphenyl)pyrimidine (CID 66314548) is 5-bromo-4,6-dichloro-2-(5-fluoro-2-methylphenyl)pyrimidine.
What is the SMILES notation for 5-bromo-4,6-dichloro-2-(5-fluoro-2-methylphenyl)pyrimidine?
The canonical SMILES for 5-bromo-4,6-dichloro-2-(5-fluoro-2-methylphenyl)pyrimidine is Cc1ccc(F)cc1-c1nc(Cl)c(Br)c(Cl)n1.
What is the InChIKey of 5-bromo-4,6-dichloro-2-(5-fluoro-2-methylphenyl)pyrimidine?
The InChIKey is QMNAKAVFXDTIGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6BrCl2FN2/c1-5-2-3-6(15)4-7(5)11-16-9(13)8(12)10(14)17-11/h2-4H,1H3.
What are the key properties of 5-bromo-4,6-dichloro-2-(5-fluoro-2-methylphenyl)pyrimidine?
5-bromo-4,6-dichloro-2-(5-fluoro-2-methylphenyl)pyrimidine has a molecular weight of 335.99 g/mol, XLogP of 4.66, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-4,6-dichloro-2-(5-fluoro-2-methylphenyl)pyrimidine is sourced from PubChem (CID 66314548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).