5-bromo-4-(4-bromo-3-fluorophenoxy)pyridin-3-amine

C11H7Br2FN2O — CID 103518810

IUPAC5-bromo-4-(4-bromo-3-fluorophenoxy)pyridin-3-amine
SMILESNc1cncc(Br)c1Oc1ccc(Br)c(F)c1
InChIInChI=1S/C11H7Br2FN2O/c12-7-2-1-6(3-9(7)14)17-11-8(13)4-16-5-10(11)15/h1-5H,15H2
InChIKeyGCSNFTAXMHHJEL-UHFFFAOYSA-N
MW362.00 g/mol
LogP4.12
Rot. Bonds2

About 5-bromo-4-(4-bromo-3-fluorophenoxy)pyridin-3-amine

5-bromo-4-(4-bromo-3-fluorophenoxy)pyridin-3-amine (PubChem CID 103518810) has the molecular formula C11H7Br2FN2O and a molecular weight of 362.00 g/mol. Its IUPAC name is 5-bromo-4-(4-bromo-3-fluorophenoxy)pyridin-3-amine.

Molecular Properties

Compound Name5-bromo-4-(4-bromo-3-fluorophenoxy)pyridin-3-amine
PubChem CID103518810
Molecular FormulaC11H7Br2FN2O
Molecular Weight362.00 g/mol
Exact Mass359.89
IUPAC Name5-bromo-4-(4-bromo-3-fluorophenoxy)pyridin-3-amine
SMILESNc1cncc(Br)c1Oc1ccc(Br)c(F)c1
InChIInChI=1S/C11H7Br2FN2O/c12-7-2-1-6(3-9(7)14)17-11-8(13)4-16-5-10(11)15/h1-5H,15H2
InChIKeyGCSNFTAXMHHJEL-UHFFFAOYSA-N
XLogP4.12
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.00
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-bromo-4-(4-bromo-3-fluorophenoxy)pyridin-3-amine?
The IUPAC name of 5-bromo-4-(4-bromo-3-fluorophenoxy)pyridin-3-amine (CID 103518810) is 5-bromo-4-(4-bromo-3-fluorophenoxy)pyridin-3-amine.
What is the SMILES notation for 5-bromo-4-(4-bromo-3-fluorophenoxy)pyridin-3-amine?
The canonical SMILES for 5-bromo-4-(4-bromo-3-fluorophenoxy)pyridin-3-amine is Nc1cncc(Br)c1Oc1ccc(Br)c(F)c1.
What is the InChIKey of 5-bromo-4-(4-bromo-3-fluorophenoxy)pyridin-3-amine?
The InChIKey is GCSNFTAXMHHJEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7Br2FN2O/c12-7-2-1-6(3-9(7)14)17-11-8(13)4-16-5-10(11)15/h1-5H,15H2.
What are the key properties of 5-bromo-4-(4-bromo-3-fluorophenoxy)pyridin-3-amine?
5-bromo-4-(4-bromo-3-fluorophenoxy)pyridin-3-amine has a molecular weight of 362.00 g/mol, XLogP of 4.12, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-4-(4-bromo-3-fluorophenoxy)pyridin-3-amine is sourced from PubChem (CID 103518810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).