6-(3-ethoxyphenoxy)-N-ethylpyridin-2-amine

C15H18N2O2 — CID 80873339

IUPAC6-(3-ethoxyphenoxy)-N-ethylpyridin-2-amine
SMILESCCNc1cccc(Oc2cccc(OCC)c2)n1
InChIInChI=1S/C15H18N2O2/c1-3-16-14-9-6-10-15(17-14)19-13-8-5-7-12(11-13)18-4-2/h5-11H,3-4H2,1-2H3,(H,16,17)
InChIKeyWKYCTJAQLXHZIP-UHFFFAOYSA-N
MW258.32 g/mol
LogP3.70
Rot. Bonds6

About 6-(3-ethoxyphenoxy)-N-ethylpyridin-2-amine

6-(3-ethoxyphenoxy)-N-ethylpyridin-2-amine (PubChem CID 80873339) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is 6-(3-ethoxyphenoxy)-N-ethylpyridin-2-amine.

Molecular Properties

Compound Name6-(3-ethoxyphenoxy)-N-ethylpyridin-2-amine
PubChem CID80873339
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC Name6-(3-ethoxyphenoxy)-N-ethylpyridin-2-amine
SMILESCCNc1cccc(Oc2cccc(OCC)c2)n1
InChIInChI=1S/C15H18N2O2/c1-3-16-14-9-6-10-15(17-14)19-13-8-5-7-12(11-13)18-4-2/h5-11H,3-4H2,1-2H3,(H,16,17)
InChIKeyWKYCTJAQLXHZIP-UHFFFAOYSA-N
XLogP3.70
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(3-ethoxyphenoxy)-N-ethylpyridin-2-amine?
The IUPAC name of 6-(3-ethoxyphenoxy)-N-ethylpyridin-2-amine (CID 80873339) is 6-(3-ethoxyphenoxy)-N-ethylpyridin-2-amine.
What is the SMILES notation for 6-(3-ethoxyphenoxy)-N-ethylpyridin-2-amine?
The canonical SMILES for 6-(3-ethoxyphenoxy)-N-ethylpyridin-2-amine is CCNc1cccc(Oc2cccc(OCC)c2)n1.
What is the InChIKey of 6-(3-ethoxyphenoxy)-N-ethylpyridin-2-amine?
The InChIKey is WKYCTJAQLXHZIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-3-16-14-9-6-10-15(17-14)19-13-8-5-7-12(11-13)18-4-2/h5-11H,3-4H2,1-2H3,(H,16,17).
What are the key properties of 6-(3-ethoxyphenoxy)-N-ethylpyridin-2-amine?
6-(3-ethoxyphenoxy)-N-ethylpyridin-2-amine has a molecular weight of 258.32 g/mol, XLogP of 3.70, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-ethoxyphenoxy)-N-ethylpyridin-2-amine is sourced from PubChem (CID 80873339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).