4-bromo-2,6-dimethyl-3,5-diphenylpyridine

C19H16BrN — CID 134973959

IUPAC4-bromo-2,6-dimethyl-3,5-diphenylpyridine
SMILESCc1nc(C)c(-c2ccccc2)c(Br)c1-c1ccccc1
InChIInChI=1S/C19H16BrN/c1-13-17(15-9-5-3-6-10-15)19(20)18(14(2)21-13)16-11-7-4-8-12-16/h3-12H,1-2H3
InChIKeyRRCPOPYKOICXMA-UHFFFAOYSA-N
MW338.25 g/mol
LogP5.79
Rot. Bonds2

About 4-bromo-2,6-dimethyl-3,5-diphenylpyridine

4-bromo-2,6-dimethyl-3,5-diphenylpyridine (PubChem CID 134973959) has the molecular formula C19H16BrN and a molecular weight of 338.25 g/mol. Its IUPAC name is 4-bromo-2,6-dimethyl-3,5-diphenylpyridine.

Molecular Properties

Compound Name4-bromo-2,6-dimethyl-3,5-diphenylpyridine
PubChem CID134973959
Molecular FormulaC19H16BrN
Molecular Weight338.25 g/mol
Exact Mass337.05
IUPAC Name4-bromo-2,6-dimethyl-3,5-diphenylpyridine
SMILESCc1nc(C)c(-c2ccccc2)c(Br)c1-c1ccccc1
InChIInChI=1S/C19H16BrN/c1-13-17(15-9-5-3-6-10-15)19(20)18(14(2)21-13)16-11-7-4-8-12-16/h3-12H,1-2H3
InChIKeyRRCPOPYKOICXMA-UHFFFAOYSA-N
XLogP5.79
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500338.25
LogP ≤ 55.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

5-bromo-2,4-dichloro-6-methyl-3-phenylpyridine
CID 59007781
5-bromo-6-methyl-2-phenylpyrimidin-4-amine
CID 66304858
2-ethyl-6-methyl-3,4,5-triphenylpyridine
CID 67766803
4-amino-2,6-dimethyl-5-phenylpyridine-3-carbonitrile
CID 69458683
8-bromo-1-methyl-3,4-diphenylisoquinoline
CID 138975285
3-bromo-5-methyl-4-phenyl-1H-pyrazole
CID 67384969
2-bromo-4-methyl-5-phenyl-1,3-oxazole
CID 105499980
2,3-dimethyl-6,7-diphenylquinoxaline
CID 163197223
4-ethyl-6-methyl-5-phenylpyrimidin-2-amine
CID 58387688
4-chloro-6-methyl-5-phenyl-2-(trifluoromethyl)pyrimidine
CID 58089417
3-bromo-4-methyl-2,5-diphenylthiophene
CID 89479588
2,3,6-trimethyl-5-phenylpyridine
CID 102473268

Frequently Asked Questions

What is the IUPAC name of 4-bromo-2,6-dimethyl-3,5-diphenylpyridine?
The IUPAC name of 4-bromo-2,6-dimethyl-3,5-diphenylpyridine (CID 134973959) is 4-bromo-2,6-dimethyl-3,5-diphenylpyridine.
What is the SMILES notation for 4-bromo-2,6-dimethyl-3,5-diphenylpyridine?
The canonical SMILES for 4-bromo-2,6-dimethyl-3,5-diphenylpyridine is Cc1nc(C)c(-c2ccccc2)c(Br)c1-c1ccccc1.
What is the InChIKey of 4-bromo-2,6-dimethyl-3,5-diphenylpyridine?
The InChIKey is RRCPOPYKOICXMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16BrN/c1-13-17(15-9-5-3-6-10-15)19(20)18(14(2)21-13)16-11-7-4-8-12-16/h3-12H,1-2H3.
What are the key properties of 4-bromo-2,6-dimethyl-3,5-diphenylpyridine?
4-bromo-2,6-dimethyl-3,5-diphenylpyridine has a molecular weight of 338.25 g/mol, XLogP of 5.79, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-2,6-dimethyl-3,5-diphenylpyridine is sourced from PubChem (CID 134973959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).