6-(2,3-dichlorophenoxy)-2-ethoxypyridin-3-amine

C13H12Cl2N2O2 — CID 43262386

IUPAC6-(2,3-dichlorophenoxy)-2-ethoxypyridin-3-amine
SMILESCCOc1nc(Oc2cccc(Cl)c2Cl)ccc1N
InChIInChI=1S/C13H12Cl2N2O2/c1-2-18-13-9(16)6-7-11(17-13)19-10-5-3-4-8(14)12(10)15/h3-7H,2,16H2,1H3
InChIKeyDBMQDRNTJKBPPU-UHFFFAOYSA-N
MW299.16 g/mol
LogP4.16
Rot. Bonds4

About 6-(2,3-dichlorophenoxy)-2-ethoxypyridin-3-amine

6-(2,3-dichlorophenoxy)-2-ethoxypyridin-3-amine (PubChem CID 43262386) has the molecular formula C13H12Cl2N2O2 and a molecular weight of 299.16 g/mol. Its IUPAC name is 6-(2,3-dichlorophenoxy)-2-ethoxypyridin-3-amine.

Molecular Properties

Compound Name6-(2,3-dichlorophenoxy)-2-ethoxypyridin-3-amine
PubChem CID43262386
Molecular FormulaC13H12Cl2N2O2
Molecular Weight299.16 g/mol
Exact Mass298.03
IUPAC Name6-(2,3-dichlorophenoxy)-2-ethoxypyridin-3-amine
SMILESCCOc1nc(Oc2cccc(Cl)c2Cl)ccc1N
InChIInChI=1S/C13H12Cl2N2O2/c1-2-18-13-9(16)6-7-11(17-13)19-10-5-3-4-8(14)12(10)15/h3-7H,2,16H2,1H3
InChIKeyDBMQDRNTJKBPPU-UHFFFAOYSA-N
XLogP4.16
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.16
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(2,3-dichlorophenoxy)-2-ethoxypyridin-3-amine?
The IUPAC name of 6-(2,3-dichlorophenoxy)-2-ethoxypyridin-3-amine (CID 43262386) is 6-(2,3-dichlorophenoxy)-2-ethoxypyridin-3-amine.
What is the SMILES notation for 6-(2,3-dichlorophenoxy)-2-ethoxypyridin-3-amine?
The canonical SMILES for 6-(2,3-dichlorophenoxy)-2-ethoxypyridin-3-amine is CCOc1nc(Oc2cccc(Cl)c2Cl)ccc1N.
What is the InChIKey of 6-(2,3-dichlorophenoxy)-2-ethoxypyridin-3-amine?
The InChIKey is DBMQDRNTJKBPPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12Cl2N2O2/c1-2-18-13-9(16)6-7-11(17-13)19-10-5-3-4-8(14)12(10)15/h3-7H,2,16H2,1H3.
What are the key properties of 6-(2,3-dichlorophenoxy)-2-ethoxypyridin-3-amine?
6-(2,3-dichlorophenoxy)-2-ethoxypyridin-3-amine has a molecular weight of 299.16 g/mol, XLogP of 4.16, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,3-dichlorophenoxy)-2-ethoxypyridin-3-amine is sourced from PubChem (CID 43262386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).