5-bromo-2-(3-bromophenoxy)pyridin-3-amine

C11H8Br2N2O — CID 61228290

IUPAC5-bromo-2-(3-bromophenoxy)pyridin-3-amine
SMILESNc1cc(Br)cnc1Oc1cccc(Br)c1
InChIInChI=1S/C11H8Br2N2O/c12-7-2-1-3-9(4-7)16-11-10(14)5-8(13)6-15-11/h1-6H,14H2
InChIKeyPCDFROZBDOGSDS-UHFFFAOYSA-N
MW344.01 g/mol
LogP3.98
Rot. Bonds2

About 5-bromo-2-(3-bromophenoxy)pyridin-3-amine

5-bromo-2-(3-bromophenoxy)pyridin-3-amine (PubChem CID 61228290) has the molecular formula C11H8Br2N2O and a molecular weight of 344.01 g/mol. Its IUPAC name is 5-bromo-2-(3-bromophenoxy)pyridin-3-amine.

Molecular Properties

Compound Name5-bromo-2-(3-bromophenoxy)pyridin-3-amine
PubChem CID61228290
Molecular FormulaC11H8Br2N2O
Molecular Weight344.01 g/mol
Exact Mass341.90
IUPAC Name5-bromo-2-(3-bromophenoxy)pyridin-3-amine
SMILESNc1cc(Br)cnc1Oc1cccc(Br)c1
InChIInChI=1S/C11H8Br2N2O/c12-7-2-1-3-9(4-7)16-11-10(14)5-8(13)6-15-11/h1-6H,14H2
InChIKeyPCDFROZBDOGSDS-UHFFFAOYSA-N
XLogP3.98
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.01
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-(3-bromophenoxy)pyridin-3-amine?
The IUPAC name of 5-bromo-2-(3-bromophenoxy)pyridin-3-amine (CID 61228290) is 5-bromo-2-(3-bromophenoxy)pyridin-3-amine.
What is the SMILES notation for 5-bromo-2-(3-bromophenoxy)pyridin-3-amine?
The canonical SMILES for 5-bromo-2-(3-bromophenoxy)pyridin-3-amine is Nc1cc(Br)cnc1Oc1cccc(Br)c1.
What is the InChIKey of 5-bromo-2-(3-bromophenoxy)pyridin-3-amine?
The InChIKey is PCDFROZBDOGSDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8Br2N2O/c12-7-2-1-3-9(4-7)16-11-10(14)5-8(13)6-15-11/h1-6H,14H2.
What are the key properties of 5-bromo-2-(3-bromophenoxy)pyridin-3-amine?
5-bromo-2-(3-bromophenoxy)pyridin-3-amine has a molecular weight of 344.01 g/mol, XLogP of 3.98, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-(3-bromophenoxy)pyridin-3-amine is sourced from PubChem (CID 61228290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).