5-bromo-2-(2,4-dichlorophenoxy)pyridin-3-amine

C11H7BrCl2N2O — CID 61228293

IUPAC5-bromo-2-(2,4-dichlorophenoxy)pyridin-3-amine
SMILESNc1cc(Br)cnc1Oc1ccc(Cl)cc1Cl
InChIInChI=1S/C11H7BrCl2N2O/c12-6-3-9(15)11(16-5-6)17-10-2-1-7(13)4-8(10)14/h1-5H,15H2
InChIKeyCEOOLXRRPXKHDW-UHFFFAOYSA-N
MW334.00 g/mol
LogP4.53
Rot. Bonds2

About 5-bromo-2-(2,4-dichlorophenoxy)pyridin-3-amine

5-bromo-2-(2,4-dichlorophenoxy)pyridin-3-amine (PubChem CID 61228293) has the molecular formula C11H7BrCl2N2O and a molecular weight of 334.00 g/mol. Its IUPAC name is 5-bromo-2-(2,4-dichlorophenoxy)pyridin-3-amine.

Molecular Properties

Compound Name5-bromo-2-(2,4-dichlorophenoxy)pyridin-3-amine
PubChem CID61228293
Molecular FormulaC11H7BrCl2N2O
Molecular Weight334.00 g/mol
Exact Mass331.91
IUPAC Name5-bromo-2-(2,4-dichlorophenoxy)pyridin-3-amine
SMILESNc1cc(Br)cnc1Oc1ccc(Cl)cc1Cl
InChIInChI=1S/C11H7BrCl2N2O/c12-6-3-9(15)11(16-5-6)17-10-2-1-7(13)4-8(10)14/h1-5H,15H2
InChIKeyCEOOLXRRPXKHDW-UHFFFAOYSA-N
XLogP4.53
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.00
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-(2,4-dichlorophenoxy)pyridin-3-amine?
The IUPAC name of 5-bromo-2-(2,4-dichlorophenoxy)pyridin-3-amine (CID 61228293) is 5-bromo-2-(2,4-dichlorophenoxy)pyridin-3-amine.
What is the SMILES notation for 5-bromo-2-(2,4-dichlorophenoxy)pyridin-3-amine?
The canonical SMILES for 5-bromo-2-(2,4-dichlorophenoxy)pyridin-3-amine is Nc1cc(Br)cnc1Oc1ccc(Cl)cc1Cl.
What is the InChIKey of 5-bromo-2-(2,4-dichlorophenoxy)pyridin-3-amine?
The InChIKey is CEOOLXRRPXKHDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7BrCl2N2O/c12-6-3-9(15)11(16-5-6)17-10-2-1-7(13)4-8(10)14/h1-5H,15H2.
What are the key properties of 5-bromo-2-(2,4-dichlorophenoxy)pyridin-3-amine?
5-bromo-2-(2,4-dichlorophenoxy)pyridin-3-amine has a molecular weight of 334.00 g/mol, XLogP of 4.53, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-(2,4-dichlorophenoxy)pyridin-3-amine is sourced from PubChem (CID 61228293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).