2-(2,3-difluorophenoxy)-1-(2-methoxyphenyl)ethanamine

C15H15F2NO2 — CID 63038149

IUPAC2-(2,3-difluorophenoxy)-1-(2-methoxyphenyl)ethanamine
SMILESCOc1ccccc1C(N)COc1cccc(F)c1F
InChIInChI=1S/C15H15F2NO2/c1-19-13-7-3-2-5-10(13)12(18)9-20-14-8-4-6-11(16)15(14)17/h2-8,12H,9,18H2,1H3
InChIKeyAYNCSTFBRNXQIA-UHFFFAOYSA-N
MW279.29 g/mol
LogP3.05
Rot. Bonds5

About 2-(2,3-difluorophenoxy)-1-(2-methoxyphenyl)ethanamine

2-(2,3-difluorophenoxy)-1-(2-methoxyphenyl)ethanamine (PubChem CID 63038149) has the molecular formula C15H15F2NO2 and a molecular weight of 279.29 g/mol. Its IUPAC name is 2-(2,3-difluorophenoxy)-1-(2-methoxyphenyl)ethanamine.

Molecular Properties

Compound Name2-(2,3-difluorophenoxy)-1-(2-methoxyphenyl)ethanamine
PubChem CID63038149
Molecular FormulaC15H15F2NO2
Molecular Weight279.29 g/mol
Exact Mass279.11
IUPAC Name2-(2,3-difluorophenoxy)-1-(2-methoxyphenyl)ethanamine
SMILESCOc1ccccc1C(N)COc1cccc(F)c1F
InChIInChI=1S/C15H15F2NO2/c1-19-13-7-3-2-5-10(13)12(18)9-20-14-8-4-6-11(16)15(14)17/h2-8,12H,9,18H2,1H3
InChIKeyAYNCSTFBRNXQIA-UHFFFAOYSA-N
XLogP3.05
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.29
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,3-difluorophenoxy)-1-(2-methoxyphenyl)ethanol
CID 63038192
2-(2,3-difluorophenoxy)-1-(2,4-difluorophenyl)ethanamine
CID 107523625
2-(2,3-difluorophenoxy)-1-(3-methoxyphenyl)ethanamine
CID 63036932
(2R)-1-(2,3-difluorophenoxy)propan-2-amine
CID 79006344
1-(2,4-difluorophenyl)-2-(2-methoxyphenoxy)ethanamine
CID 16783272
2-(2,3-difluorophenoxy)-1-(4-ethylphenyl)ethanamine
CID 63036402
1-(2,3-difluorophenoxy)-3,3-dimethylbutan-2-amine
CID 63037624
(1S)-1-(2-methoxyphenyl)propane-1,3-diamine
CID 171219974
1-(2,5-difluorophenyl)-2-(2-fluoro-3-methylphenoxy)ethanamine
CID 107657092
1-(2-methoxy-5-methylphenyl)-2-(2-methoxyphenoxy)ethanamine
CID 16785142
1-(2-methoxyphenyl)-2-(2,4,6-trimethylphenoxy)ethanamine
CID 61220878
2-(2-methoxyethoxy)-1-(2-methoxyphenyl)ethanamine
CID 43184458

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-difluorophenoxy)-1-(2-methoxyphenyl)ethanamine?
The IUPAC name of 2-(2,3-difluorophenoxy)-1-(2-methoxyphenyl)ethanamine (CID 63038149) is 2-(2,3-difluorophenoxy)-1-(2-methoxyphenyl)ethanamine.
What is the SMILES notation for 2-(2,3-difluorophenoxy)-1-(2-methoxyphenyl)ethanamine?
The canonical SMILES for 2-(2,3-difluorophenoxy)-1-(2-methoxyphenyl)ethanamine is COc1ccccc1C(N)COc1cccc(F)c1F.
What is the InChIKey of 2-(2,3-difluorophenoxy)-1-(2-methoxyphenyl)ethanamine?
The InChIKey is AYNCSTFBRNXQIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15F2NO2/c1-19-13-7-3-2-5-10(13)12(18)9-20-14-8-4-6-11(16)15(14)17/h2-8,12H,9,18H2,1H3.
What are the key properties of 2-(2,3-difluorophenoxy)-1-(2-methoxyphenyl)ethanamine?
2-(2,3-difluorophenoxy)-1-(2-methoxyphenyl)ethanamine has a molecular weight of 279.29 g/mol, XLogP of 3.05, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-difluorophenoxy)-1-(2-methoxyphenyl)ethanamine is sourced from PubChem (CID 63038149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).