3-bromo-2-(2,4,6-trimethylphenyl)pyridine

C14H14BrN — CID 160653296

IUPAC3-bromo-2-(2,4,6-trimethylphenyl)pyridine
SMILESCc1cc(C)c(-c2ncccc2Br)c(C)c1
InChIInChI=1S/C14H14BrN/c1-9-7-10(2)13(11(3)8-9)14-12(15)5-4-6-16-14/h4-8H,1-3H3
InChIKeyXBOYFPQQNRGJSC-UHFFFAOYSA-N
MW276.18 g/mol
LogP4.44
Rot. Bonds1

About 3-bromo-2-(2,4,6-trimethylphenyl)pyridine

3-bromo-2-(2,4,6-trimethylphenyl)pyridine (PubChem CID 160653296) has the molecular formula C14H14BrN and a molecular weight of 276.18 g/mol. Its IUPAC name is 3-bromo-2-(2,4,6-trimethylphenyl)pyridine.

Molecular Properties

Compound Name3-bromo-2-(2,4,6-trimethylphenyl)pyridine
PubChem CID160653296
Molecular FormulaC14H14BrN
Molecular Weight276.18 g/mol
Exact Mass275.03
IUPAC Name3-bromo-2-(2,4,6-trimethylphenyl)pyridine
SMILESCc1cc(C)c(-c2ncccc2Br)c(C)c1
InChIInChI=1S/C14H14BrN/c1-9-7-10(2)13(11(3)8-9)14-12(15)5-4-6-16-14/h4-8H,1-3H3
InChIKeyXBOYFPQQNRGJSC-UHFFFAOYSA-N
XLogP4.44
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.18
LogP ≤ 54.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-bromo-2-(2,4-dimethylphenyl)pyridine
CID 83920163
2-(2-fluoro-4,6-dimethylphenyl)pyridin-3-amine
CID 106882203
2-(3,5-dibromophenyl)-3-methylpyridine
CID 155769988
2-(2-bromo-4-methylphenyl)-3-methylpyridine
CID 177492529
3-bromo-2-[2-[2-(3-bromo-2-pyridinyl)phenyl]phenyl]pyridine
CID 102358252
2-bromo-4-(2,4,6-trimethylphenyl)pyridine
CID 168984492
4-pyridin-2-yl-3-(2,4,6-trimethylphenyl)-1,2-oxazol-5-amine
CID 80521077
2-(3-bromo-2-pyridinyl)-3-ethylpyridine
CID 167433763
2-(3-bromo-2-pyridinyl)-4,7-dimethylisoindole-1,3-dione
CID 103430551
2-[(3-bromo-2-pyridinyl)sulfanyl]-4-methylpyridine;hydrochloride
CID 163333008
2-(3-bromo-4-methylphenyl)pyridin-3-amine
CID 82379977
3-(2,4,6-trimethylphenyl)pyrazine-2-carboxylic acid
CID 82477716

Frequently Asked Questions

What is the IUPAC name of 3-bromo-2-(2,4,6-trimethylphenyl)pyridine?
The IUPAC name of 3-bromo-2-(2,4,6-trimethylphenyl)pyridine (CID 160653296) is 3-bromo-2-(2,4,6-trimethylphenyl)pyridine.
What is the SMILES notation for 3-bromo-2-(2,4,6-trimethylphenyl)pyridine?
The canonical SMILES for 3-bromo-2-(2,4,6-trimethylphenyl)pyridine is Cc1cc(C)c(-c2ncccc2Br)c(C)c1.
What is the InChIKey of 3-bromo-2-(2,4,6-trimethylphenyl)pyridine?
The InChIKey is XBOYFPQQNRGJSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14BrN/c1-9-7-10(2)13(11(3)8-9)14-12(15)5-4-6-16-14/h4-8H,1-3H3.
What are the key properties of 3-bromo-2-(2,4,6-trimethylphenyl)pyridine?
3-bromo-2-(2,4,6-trimethylphenyl)pyridine has a molecular weight of 276.18 g/mol, XLogP of 4.44, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-2-(2,4,6-trimethylphenyl)pyridine is sourced from PubChem (CID 160653296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).