2-[2-(3-ethoxyphenoxy)phenyl]ethanamine

C16H19NO2 — CID 63804354

IUPAC2-[2-(3-ethoxyphenoxy)phenyl]ethanamine
SMILESCCOc1cccc(Oc2ccccc2CCN)c1
InChIInChI=1S/C16H19NO2/c1-2-18-14-7-5-8-15(12-14)19-16-9-4-3-6-13(16)10-11-17/h3-9,12H,2,10-11,17H2,1H3
InChIKeyHVTHBTJEUFVOSI-UHFFFAOYSA-N
MW257.33 g/mol
LogP3.38
Rot. Bonds6

About 2-[2-(3-ethoxyphenoxy)phenyl]ethanamine

2-[2-(3-ethoxyphenoxy)phenyl]ethanamine (PubChem CID 63804354) has the molecular formula C16H19NO2 and a molecular weight of 257.33 g/mol. Its IUPAC name is 2-[2-(3-ethoxyphenoxy)phenyl]ethanamine.

Molecular Properties

Compound Name2-[2-(3-ethoxyphenoxy)phenyl]ethanamine
PubChem CID63804354
Molecular FormulaC16H19NO2
Molecular Weight257.33 g/mol
Exact Mass257.14
IUPAC Name2-[2-(3-ethoxyphenoxy)phenyl]ethanamine
SMILESCCOc1cccc(Oc2ccccc2CCN)c1
InChIInChI=1S/C16H19NO2/c1-2-18-14-7-5-8-15(12-14)19-16-9-4-3-6-13(16)10-11-17/h3-9,12H,2,10-11,17H2,1H3
InChIKeyHVTHBTJEUFVOSI-UHFFFAOYSA-N
XLogP3.38
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.33
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(3-iodophenoxy)phenyl]ethanamine
CID 63803655
[5-chloro-2-(3-ethoxyphenoxy)phenyl]methanamine
CID 62494201
1-[2-(3-ethoxyphenoxy)phenyl]propan-1-amine
CID 115995673
2-(3-ethoxyphenoxy)benzonitrile
CID 62336711
3-ethoxy-5-(2-ethylphenoxy)aniline
CID 80747947
2-(2-pyridin-3-yloxyphenyl)ethanamine
CID 63816614
2-[2-(4-butylphenoxy)phenyl]ethanamine
CID 115493511
2-[5-chloro-2-(4-ethoxyphenoxy)phenyl]ethanamine
CID 114862746
2-[3-(4-ethoxyphenoxy)phenyl]ethanamine
CID 63941757
3-[2-[2-[2-(4-aminophenoxy)phenyl]ethyl]phenoxy]aniline
CID 67120556
2-[5-chloro-2-(3-methoxyphenoxy)phenyl]ethanamine
CID 114862794
1-[2-(3-ethoxyphenoxy)phenyl]-N-methylethanamine
CID 62337869

Frequently Asked Questions

What is the IUPAC name of 2-[2-(3-ethoxyphenoxy)phenyl]ethanamine?
The IUPAC name of 2-[2-(3-ethoxyphenoxy)phenyl]ethanamine (CID 63804354) is 2-[2-(3-ethoxyphenoxy)phenyl]ethanamine.
What is the SMILES notation for 2-[2-(3-ethoxyphenoxy)phenyl]ethanamine?
The canonical SMILES for 2-[2-(3-ethoxyphenoxy)phenyl]ethanamine is CCOc1cccc(Oc2ccccc2CCN)c1.
What is the InChIKey of 2-[2-(3-ethoxyphenoxy)phenyl]ethanamine?
The InChIKey is HVTHBTJEUFVOSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO2/c1-2-18-14-7-5-8-15(12-14)19-16-9-4-3-6-13(16)10-11-17/h3-9,12H,2,10-11,17H2,1H3.
What are the key properties of 2-[2-(3-ethoxyphenoxy)phenyl]ethanamine?
2-[2-(3-ethoxyphenoxy)phenyl]ethanamine has a molecular weight of 257.33 g/mol, XLogP of 3.38, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(3-ethoxyphenoxy)phenyl]ethanamine is sourced from PubChem (CID 63804354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).