2-(4-ethyl-2-methoxyphenoxy)-5-methylpyridin-4-amine

C15H18N2O2 — CID 107663796

IUPAC2-(4-ethyl-2-methoxyphenoxy)-5-methylpyridin-4-amine
SMILESCCc1ccc(Oc2cc(N)c(C)cn2)c(OC)c1
InChIInChI=1S/C15H18N2O2/c1-4-11-5-6-13(14(7-11)18-3)19-15-8-12(16)10(2)9-17-15/h5-9H,4H2,1-3H3,(H2,16,17)
InChIKeyXNBNKTQOSIJHEK-UHFFFAOYSA-N
MW258.32 g/mol
LogP3.34
Rot. Bonds4

About 2-(4-ethyl-2-methoxyphenoxy)-5-methylpyridin-4-amine

2-(4-ethyl-2-methoxyphenoxy)-5-methylpyridin-4-amine (PubChem CID 107663796) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is 2-(4-ethyl-2-methoxyphenoxy)-5-methylpyridin-4-amine.

Molecular Properties

Compound Name2-(4-ethyl-2-methoxyphenoxy)-5-methylpyridin-4-amine
PubChem CID107663796
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC Name2-(4-ethyl-2-methoxyphenoxy)-5-methylpyridin-4-amine
SMILESCCc1ccc(Oc2cc(N)c(C)cn2)c(OC)c1
InChIInChI=1S/C15H18N2O2/c1-4-11-5-6-13(14(7-11)18-3)19-15-8-12(16)10(2)9-17-15/h5-9H,4H2,1-3H3,(H2,16,17)
InChIKeyXNBNKTQOSIJHEK-UHFFFAOYSA-N
XLogP3.34
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-ethyl-2-methoxyphenoxy)-5-methylpyridin-4-amine?
The IUPAC name of 2-(4-ethyl-2-methoxyphenoxy)-5-methylpyridin-4-amine (CID 107663796) is 2-(4-ethyl-2-methoxyphenoxy)-5-methylpyridin-4-amine.
What is the SMILES notation for 2-(4-ethyl-2-methoxyphenoxy)-5-methylpyridin-4-amine?
The canonical SMILES for 2-(4-ethyl-2-methoxyphenoxy)-5-methylpyridin-4-amine is CCc1ccc(Oc2cc(N)c(C)cn2)c(OC)c1.
What is the InChIKey of 2-(4-ethyl-2-methoxyphenoxy)-5-methylpyridin-4-amine?
The InChIKey is XNBNKTQOSIJHEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-4-11-5-6-13(14(7-11)18-3)19-15-8-12(16)10(2)9-17-15/h5-9H,4H2,1-3H3,(H2,16,17).
What are the key properties of 2-(4-ethyl-2-methoxyphenoxy)-5-methylpyridin-4-amine?
2-(4-ethyl-2-methoxyphenoxy)-5-methylpyridin-4-amine has a molecular weight of 258.32 g/mol, XLogP of 3.34, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethyl-2-methoxyphenoxy)-5-methylpyridin-4-amine is sourced from PubChem (CID 107663796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).