5-bromo-N-(2-bromo-4-fluorophenyl)-4-methylpyridin-2-amine

C12H9Br2FN2 — CID 114870130

IUPAC5-bromo-N-(2-bromo-4-fluorophenyl)-4-methylpyridin-2-amine
SMILESCc1cc(Nc2ccc(F)cc2Br)ncc1Br
InChIInChI=1S/C12H9Br2FN2/c1-7-4-12(16-6-10(7)14)17-11-3-2-8(15)5-9(11)13/h2-6H,1H3,(H,16,17)
InChIKeyLRFKFXWBVXWGNU-UHFFFAOYSA-N
MW360.02 g/mol
LogP4.80
Rot. Bonds2

About 5-bromo-N-(2-bromo-4-fluorophenyl)-4-methylpyridin-2-amine

5-bromo-N-(2-bromo-4-fluorophenyl)-4-methylpyridin-2-amine (PubChem CID 114870130) has the molecular formula C12H9Br2FN2 and a molecular weight of 360.02 g/mol. Its IUPAC name is 5-bromo-N-(2-bromo-4-fluorophenyl)-4-methylpyridin-2-amine.

Molecular Properties

Compound Name5-bromo-N-(2-bromo-4-fluorophenyl)-4-methylpyridin-2-amine
PubChem CID114870130
Molecular FormulaC12H9Br2FN2
Molecular Weight360.02 g/mol
Exact Mass357.91
IUPAC Name5-bromo-N-(2-bromo-4-fluorophenyl)-4-methylpyridin-2-amine
SMILESCc1cc(Nc2ccc(F)cc2Br)ncc1Br
InChIInChI=1S/C12H9Br2FN2/c1-7-4-12(16-6-10(7)14)17-11-3-2-8(15)5-9(11)13/h2-6H,1H3,(H,16,17)
InChIKeyLRFKFXWBVXWGNU-UHFFFAOYSA-N
XLogP4.80
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.02
LogP ≤ 54.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-bromo-N-(4-bromo-2-methylphenyl)-4-methylpyridin-2-amine
CID 114870136
5-bromo-4-methyl-N-(2-methylsulfanylphenyl)pyridin-2-amine
CID 107645866
5-bromo-N-(2-bromo-5-methylphenyl)-4-methylpyridin-2-amine
CID 114870518
5-bromo-N-(2,5-dimethylphenyl)-4-methylpyridin-2-amine
CID 114870190
5-bromo-N-(2-bromo-5-chlorophenyl)-4-methylpyridin-2-amine
CID 114870498
N-(2-bromo-4-fluorophenyl)-6-chloropyrimidin-4-amine
CID 61279571
2-N-(2,4-dibromophenyl)-4-methylpyridine-2,5-diamine
CID 79173349
N-(2-bromo-4-fluorophenyl)-6-chloro-2-methylpyrimidin-4-amine
CID 62481305
5-bromo-N-(5-tert-butyl-2-methylphenyl)-4-methylpyridin-2-amine
CID 115146961
5-bromo-N-(2-chloro-5-methylphenyl)-4-methylpyridin-2-amine
CID 107638028
5-bromo-2-(2-bromo-4-fluorophenoxy)-4-methylpyridine
CID 114869079
5-bromo-N-(2-ethylphenyl)-4-methylpyridin-2-amine
CID 114870208

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(2-bromo-4-fluorophenyl)-4-methylpyridin-2-amine?
The IUPAC name of 5-bromo-N-(2-bromo-4-fluorophenyl)-4-methylpyridin-2-amine (CID 114870130) is 5-bromo-N-(2-bromo-4-fluorophenyl)-4-methylpyridin-2-amine.
What is the SMILES notation for 5-bromo-N-(2-bromo-4-fluorophenyl)-4-methylpyridin-2-amine?
The canonical SMILES for 5-bromo-N-(2-bromo-4-fluorophenyl)-4-methylpyridin-2-amine is Cc1cc(Nc2ccc(F)cc2Br)ncc1Br.
What is the InChIKey of 5-bromo-N-(2-bromo-4-fluorophenyl)-4-methylpyridin-2-amine?
The InChIKey is LRFKFXWBVXWGNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9Br2FN2/c1-7-4-12(16-6-10(7)14)17-11-3-2-8(15)5-9(11)13/h2-6H,1H3,(H,16,17).
What are the key properties of 5-bromo-N-(2-bromo-4-fluorophenyl)-4-methylpyridin-2-amine?
5-bromo-N-(2-bromo-4-fluorophenyl)-4-methylpyridin-2-amine has a molecular weight of 360.02 g/mol, XLogP of 4.80, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(2-bromo-4-fluorophenyl)-4-methylpyridin-2-amine is sourced from PubChem (CID 114870130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).