6-(4-bromo-3-fluorophenoxy)-4-methylpyridin-3-amine

C12H10BrFN2O — CID 79176366

IUPAC6-(4-bromo-3-fluorophenoxy)-4-methylpyridin-3-amine
SMILESCc1cc(Oc2ccc(Br)c(F)c2)ncc1N
InChIInChI=1S/C12H10BrFN2O/c1-7-4-12(16-6-11(7)15)17-8-2-3-9(13)10(14)5-8/h2-6H,15H2,1H3
InChIKeyQEZHZKRHZRISOJ-UHFFFAOYSA-N
MW297.13 g/mol
LogP3.67
Rot. Bonds2

About 6-(4-bromo-3-fluorophenoxy)-4-methylpyridin-3-amine

6-(4-bromo-3-fluorophenoxy)-4-methylpyridin-3-amine (PubChem CID 79176366) has the molecular formula C12H10BrFN2O and a molecular weight of 297.13 g/mol. Its IUPAC name is 6-(4-bromo-3-fluorophenoxy)-4-methylpyridin-3-amine.

Molecular Properties

Compound Name6-(4-bromo-3-fluorophenoxy)-4-methylpyridin-3-amine
PubChem CID79176366
Molecular FormulaC12H10BrFN2O
Molecular Weight297.13 g/mol
Exact Mass296.00
IUPAC Name6-(4-bromo-3-fluorophenoxy)-4-methylpyridin-3-amine
SMILESCc1cc(Oc2ccc(Br)c(F)c2)ncc1N
InChIInChI=1S/C12H10BrFN2O/c1-7-4-12(16-6-11(7)15)17-8-2-3-9(13)10(14)5-8/h2-6H,15H2,1H3
InChIKeyQEZHZKRHZRISOJ-UHFFFAOYSA-N
XLogP3.67
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.13
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-(3,4-dimethylphenoxy)-4-methylpyridin-3-amine
CID 79021050
2-(3-fluoro-4-methylphenoxy)-5-methylpyridin-4-amine
CID 107168502
6-(2,4-difluorophenoxy)-4-methylpyridin-3-amine
CID 79175877
6-(4-bromo-3-fluorophenoxy)-5-methylpyridin-3-amine
CID 65203527
4-methyl-6-(3-methylphenoxy)pyridin-3-amine
CID 79020882
6-(3,5-dimethylphenoxy)-4-methylpyridin-3-amine
CID 79020990
6-(2,3-dihydro-1H-inden-5-yloxy)-4-methylpyridin-3-amine
CID 79176837
5-amino-2-(4-bromo-3-methylphenoxy)pyridine-4-carboxylic acid
CID 114090810
4-(4-bromo-3-fluorophenoxy)benzene-1,2-diamine
CID 106748501
6-(4-bromo-3-fluorophenoxy)pyridine-3-carbothioamide
CID 65203705
6-(4-bromo-3-fluorophenoxy)pyrimidine-2,4-diamine
CID 80878320
5-bromo-4-(4-bromo-3-fluorophenoxy)pyridin-3-amine
CID 103518810

Frequently Asked Questions

What is the IUPAC name of 6-(4-bromo-3-fluorophenoxy)-4-methylpyridin-3-amine?
The IUPAC name of 6-(4-bromo-3-fluorophenoxy)-4-methylpyridin-3-amine (CID 79176366) is 6-(4-bromo-3-fluorophenoxy)-4-methylpyridin-3-amine.
What is the SMILES notation for 6-(4-bromo-3-fluorophenoxy)-4-methylpyridin-3-amine?
The canonical SMILES for 6-(4-bromo-3-fluorophenoxy)-4-methylpyridin-3-amine is Cc1cc(Oc2ccc(Br)c(F)c2)ncc1N.
What is the InChIKey of 6-(4-bromo-3-fluorophenoxy)-4-methylpyridin-3-amine?
The InChIKey is QEZHZKRHZRISOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10BrFN2O/c1-7-4-12(16-6-11(7)15)17-8-2-3-9(13)10(14)5-8/h2-6H,15H2,1H3.
What are the key properties of 6-(4-bromo-3-fluorophenoxy)-4-methylpyridin-3-amine?
6-(4-bromo-3-fluorophenoxy)-4-methylpyridin-3-amine has a molecular weight of 297.13 g/mol, XLogP of 3.67, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-bromo-3-fluorophenoxy)-4-methylpyridin-3-amine is sourced from PubChem (CID 79176366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).