2-(4-ethoxyphenyl)-1-(furan-2-yl)ethanamine

C14H17NO2 — CID 22299339

IUPAC2-(4-ethoxyphenyl)-1-(furan-2-yl)ethanamine
SMILESCCOc1ccc(CC(N)c2ccco2)cc1
InChIInChI=1S/C14H17NO2/c1-2-16-12-7-5-11(6-8-12)10-13(15)14-4-3-9-17-14/h3-9,13H,2,10,15H2,1H3
InChIKeyDUXOGLFFZAZDGA-UHFFFAOYSA-N
MW231.29 g/mol
LogP2.92
Rot. Bonds5

About 2-(4-ethoxyphenyl)-1-(furan-2-yl)ethanamine

2-(4-ethoxyphenyl)-1-(furan-2-yl)ethanamine (PubChem CID 22299339) has the molecular formula C14H17NO2 and a molecular weight of 231.29 g/mol. Its IUPAC name is 2-(4-ethoxyphenyl)-1-(furan-2-yl)ethanamine.

Molecular Properties

Compound Name2-(4-ethoxyphenyl)-1-(furan-2-yl)ethanamine
PubChem CID22299339
Molecular FormulaC14H17NO2
Molecular Weight231.29 g/mol
Exact Mass231.13
IUPAC Name2-(4-ethoxyphenyl)-1-(furan-2-yl)ethanamine
SMILESCCOc1ccc(CC(N)c2ccco2)cc1
InChIInChI=1S/C14H17NO2/c1-2-16-12-7-5-11(6-8-12)10-13(15)14-4-3-9-17-14/h3-9,13H,2,10,15H2,1H3
InChIKeyDUXOGLFFZAZDGA-UHFFFAOYSA-N
XLogP2.92
TPSA48.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.29
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-ethoxyphenyl)-1-(furan-2-yl)ethanamine?
The IUPAC name of 2-(4-ethoxyphenyl)-1-(furan-2-yl)ethanamine (CID 22299339) is 2-(4-ethoxyphenyl)-1-(furan-2-yl)ethanamine.
What is the SMILES notation for 2-(4-ethoxyphenyl)-1-(furan-2-yl)ethanamine?
The canonical SMILES for 2-(4-ethoxyphenyl)-1-(furan-2-yl)ethanamine is CCOc1ccc(CC(N)c2ccco2)cc1.
What is the InChIKey of 2-(4-ethoxyphenyl)-1-(furan-2-yl)ethanamine?
The InChIKey is DUXOGLFFZAZDGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO2/c1-2-16-12-7-5-11(6-8-12)10-13(15)14-4-3-9-17-14/h3-9,13H,2,10,15H2,1H3.
What are the key properties of 2-(4-ethoxyphenyl)-1-(furan-2-yl)ethanamine?
2-(4-ethoxyphenyl)-1-(furan-2-yl)ethanamine has a molecular weight of 231.29 g/mol, XLogP of 2.92, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethoxyphenyl)-1-(furan-2-yl)ethanamine is sourced from PubChem (CID 22299339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).