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

C14H16N2O — CID 22299211

IUPAC2-(2-methoxyphenyl)-1-pyridin-3-ylethanamine
SMILESCOc1ccccc1CC(N)c1cccnc1
InChIInChI=1S/C14H16N2O/c1-17-14-7-3-2-5-11(14)9-13(15)12-6-4-8-16-10-12/h2-8,10,13H,9,15H2,1H3
InChIKeyZVMOARQZFRJOIW-UHFFFAOYSA-N
MW228.30 g/mol
LogP2.33
Rot. Bonds4

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

2-(2-methoxyphenyl)-1-pyridin-3-ylethanamine (PubChem CID 22299211) has the molecular formula C14H16N2O and a molecular weight of 228.30 g/mol. Its IUPAC name is 2-(2-methoxyphenyl)-1-pyridin-3-ylethanamine.

Molecular Properties

Compound Name2-(2-methoxyphenyl)-1-pyridin-3-ylethanamine
PubChem CID22299211
Molecular FormulaC14H16N2O
Molecular Weight228.30 g/mol
Exact Mass228.13
IUPAC Name2-(2-methoxyphenyl)-1-pyridin-3-ylethanamine
SMILESCOc1ccccc1CC(N)c1cccnc1
InChIInChI=1S/C14H16N2O/c1-17-14-7-3-2-5-11(14)9-13(15)12-6-4-8-16-10-12/h2-8,10,13H,9,15H2,1H3
InChIKeyZVMOARQZFRJOIW-UHFFFAOYSA-N
XLogP2.33
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenyl)-1-pyridin-3-ylethanamine?
The IUPAC name of 2-(2-methoxyphenyl)-1-pyridin-3-ylethanamine (CID 22299211) is 2-(2-methoxyphenyl)-1-pyridin-3-ylethanamine.
What is the SMILES notation for 2-(2-methoxyphenyl)-1-pyridin-3-ylethanamine?
The canonical SMILES for 2-(2-methoxyphenyl)-1-pyridin-3-ylethanamine is COc1ccccc1CC(N)c1cccnc1.
What is the InChIKey of 2-(2-methoxyphenyl)-1-pyridin-3-ylethanamine?
The InChIKey is ZVMOARQZFRJOIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O/c1-17-14-7-3-2-5-11(14)9-13(15)12-6-4-8-16-10-12/h2-8,10,13H,9,15H2,1H3.
What are the key properties of 2-(2-methoxyphenyl)-1-pyridin-3-ylethanamine?
2-(2-methoxyphenyl)-1-pyridin-3-ylethanamine has a molecular weight of 228.30 g/mol, XLogP of 2.33, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenyl)-1-pyridin-3-ylethanamine is sourced from PubChem (CID 22299211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).