6-(2,3-dichlorophenoxy)pyridine-2,3-diamine

C11H9Cl2N3O — CID 79826072

IUPAC6-(2,3-dichlorophenoxy)pyridine-2,3-diamine
SMILESNc1ccc(Oc2cccc(Cl)c2Cl)nc1N
InChIInChI=1S/C11H9Cl2N3O/c12-6-2-1-3-8(10(6)13)17-9-5-4-7(14)11(15)16-9/h1-5H,14H2,(H2,15,16)
InChIKeyOGWCPRXCHDBRLI-UHFFFAOYSA-N
MW270.12 g/mol
LogP3.35
Rot. Bonds2

About 6-(2,3-dichlorophenoxy)pyridine-2,3-diamine

6-(2,3-dichlorophenoxy)pyridine-2,3-diamine (PubChem CID 79826072) has the molecular formula C11H9Cl2N3O and a molecular weight of 270.12 g/mol. Its IUPAC name is 6-(2,3-dichlorophenoxy)pyridine-2,3-diamine.

Molecular Properties

Compound Name6-(2,3-dichlorophenoxy)pyridine-2,3-diamine
PubChem CID79826072
Molecular FormulaC11H9Cl2N3O
Molecular Weight270.12 g/mol
Exact Mass269.01
IUPAC Name6-(2,3-dichlorophenoxy)pyridine-2,3-diamine
SMILESNc1ccc(Oc2cccc(Cl)c2Cl)nc1N
InChIInChI=1S/C11H9Cl2N3O/c12-6-2-1-3-8(10(6)13)17-9-5-4-7(14)11(15)16-9/h1-5H,14H2,(H2,15,16)
InChIKeyOGWCPRXCHDBRLI-UHFFFAOYSA-N
XLogP3.35
TPSA74.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.12
LogP ≤ 53.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(2,3-dichlorophenoxy)pyridine-2,3-diamine?
The IUPAC name of 6-(2,3-dichlorophenoxy)pyridine-2,3-diamine (CID 79826072) is 6-(2,3-dichlorophenoxy)pyridine-2,3-diamine.
What is the SMILES notation for 6-(2,3-dichlorophenoxy)pyridine-2,3-diamine?
The canonical SMILES for 6-(2,3-dichlorophenoxy)pyridine-2,3-diamine is Nc1ccc(Oc2cccc(Cl)c2Cl)nc1N.
What is the InChIKey of 6-(2,3-dichlorophenoxy)pyridine-2,3-diamine?
The InChIKey is OGWCPRXCHDBRLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9Cl2N3O/c12-6-2-1-3-8(10(6)13)17-9-5-4-7(14)11(15)16-9/h1-5H,14H2,(H2,15,16).
What are the key properties of 6-(2,3-dichlorophenoxy)pyridine-2,3-diamine?
6-(2,3-dichlorophenoxy)pyridine-2,3-diamine has a molecular weight of 270.12 g/mol, XLogP of 3.35, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,3-dichlorophenoxy)pyridine-2,3-diamine is sourced from PubChem (CID 79826072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).