2-(3-methoxyphenoxy)-1-pyridin-2-ylethanamine

C14H16N2O2 — CID 117241389

IUPAC2-(3-methoxyphenoxy)-1-pyridin-2-ylethanamine
SMILESCOc1cccc(OCC(N)c2ccccn2)c1
InChIInChI=1S/C14H16N2O2/c1-17-11-5-4-6-12(9-11)18-10-13(15)14-7-2-3-8-16-14/h2-9,13H,10,15H2,1H3
InChIKeyOHKWGTSJXPYMJS-UHFFFAOYSA-N
MW244.29 g/mol
LogP2.17
Rot. Bonds5

About 2-(3-methoxyphenoxy)-1-pyridin-2-ylethanamine

2-(3-methoxyphenoxy)-1-pyridin-2-ylethanamine (PubChem CID 117241389) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is 2-(3-methoxyphenoxy)-1-pyridin-2-ylethanamine.

Molecular Properties

Compound Name2-(3-methoxyphenoxy)-1-pyridin-2-ylethanamine
PubChem CID117241389
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC Name2-(3-methoxyphenoxy)-1-pyridin-2-ylethanamine
SMILESCOc1cccc(OCC(N)c2ccccn2)c1
InChIInChI=1S/C14H16N2O2/c1-17-11-5-4-6-12(9-11)18-10-13(15)14-7-2-3-8-16-14/h2-9,13H,10,15H2,1H3
InChIKeyOHKWGTSJXPYMJS-UHFFFAOYSA-N
XLogP2.17
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyphenoxy)-1-pyridin-2-ylethanamine?
The IUPAC name of 2-(3-methoxyphenoxy)-1-pyridin-2-ylethanamine (CID 117241389) is 2-(3-methoxyphenoxy)-1-pyridin-2-ylethanamine.
What is the SMILES notation for 2-(3-methoxyphenoxy)-1-pyridin-2-ylethanamine?
The canonical SMILES for 2-(3-methoxyphenoxy)-1-pyridin-2-ylethanamine is COc1cccc(OCC(N)c2ccccn2)c1.
What is the InChIKey of 2-(3-methoxyphenoxy)-1-pyridin-2-ylethanamine?
The InChIKey is OHKWGTSJXPYMJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c1-17-11-5-4-6-12(9-11)18-10-13(15)14-7-2-3-8-16-14/h2-9,13H,10,15H2,1H3.
What are the key properties of 2-(3-methoxyphenoxy)-1-pyridin-2-ylethanamine?
2-(3-methoxyphenoxy)-1-pyridin-2-ylethanamine has a molecular weight of 244.29 g/mol, XLogP of 2.17, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyphenoxy)-1-pyridin-2-ylethanamine is sourced from PubChem (CID 117241389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).