2-[4-(2-methoxyphenoxy)phenyl]ethanamine

C15H17NO2 — CID 20986924

IUPAC2-[4-(2-methoxyphenoxy)phenyl]ethanamine
SMILESCOc1ccccc1Oc1ccc(CCN)cc1
InChIInChI=1S/C15H17NO2/c1-17-14-4-2-3-5-15(14)18-13-8-6-12(7-9-13)10-11-16/h2-9H,10-11,16H2,1H3
InChIKeyAVSUOHFWAWWDQN-UHFFFAOYSA-N
MW243.31 g/mol
LogP2.99
Rot. Bonds5

About 2-[4-(2-methoxyphenoxy)phenyl]ethanamine

2-[4-(2-methoxyphenoxy)phenyl]ethanamine (PubChem CID 20986924) has the molecular formula C15H17NO2 and a molecular weight of 243.31 g/mol. Its IUPAC name is 2-[4-(2-methoxyphenoxy)phenyl]ethanamine.

Molecular Properties

Compound Name2-[4-(2-methoxyphenoxy)phenyl]ethanamine
PubChem CID20986924
Molecular FormulaC15H17NO2
Molecular Weight243.31 g/mol
Exact Mass243.13
IUPAC Name2-[4-(2-methoxyphenoxy)phenyl]ethanamine
SMILESCOc1ccccc1Oc1ccc(CCN)cc1
InChIInChI=1S/C15H17NO2/c1-17-14-4-2-3-5-15(14)18-13-8-6-12(7-9-13)10-11-16/h2-9H,10-11,16H2,1H3
InChIKeyAVSUOHFWAWWDQN-UHFFFAOYSA-N
XLogP2.99
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-methoxyphenoxy)phenyl]ethanamine?
The IUPAC name of 2-[4-(2-methoxyphenoxy)phenyl]ethanamine (CID 20986924) is 2-[4-(2-methoxyphenoxy)phenyl]ethanamine.
What is the SMILES notation for 2-[4-(2-methoxyphenoxy)phenyl]ethanamine?
The canonical SMILES for 2-[4-(2-methoxyphenoxy)phenyl]ethanamine is COc1ccccc1Oc1ccc(CCN)cc1.
What is the InChIKey of 2-[4-(2-methoxyphenoxy)phenyl]ethanamine?
The InChIKey is AVSUOHFWAWWDQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO2/c1-17-14-4-2-3-5-15(14)18-13-8-6-12(7-9-13)10-11-16/h2-9H,10-11,16H2,1H3.
What are the key properties of 2-[4-(2-methoxyphenoxy)phenyl]ethanamine?
2-[4-(2-methoxyphenoxy)phenyl]ethanamine has a molecular weight of 243.31 g/mol, XLogP of 2.99, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-methoxyphenoxy)phenyl]ethanamine is sourced from PubChem (CID 20986924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).