2-(2-fluorophenoxy)-1-(3-fluorophenyl)ethanamine

C14H13F2NO — CID 18070424

IUPAC2-(2-fluorophenoxy)-1-(3-fluorophenyl)ethanamine
SMILESNC(COc1ccccc1F)c1cccc(F)c1
InChIInChI=1S/C14H13F2NO/c15-11-5-3-4-10(8-11)13(17)9-18-14-7-2-1-6-12(14)16/h1-8,13H,9,17H2
InChIKeyZMMXQCIVLTVNMP-UHFFFAOYSA-N
MW249.26 g/mol
LogP3.04
Rot. Bonds4

About 2-(2-fluorophenoxy)-1-(3-fluorophenyl)ethanamine

2-(2-fluorophenoxy)-1-(3-fluorophenyl)ethanamine (PubChem CID 18070424) has the molecular formula C14H13F2NO and a molecular weight of 249.26 g/mol. Its IUPAC name is 2-(2-fluorophenoxy)-1-(3-fluorophenyl)ethanamine.

Molecular Properties

Compound Name2-(2-fluorophenoxy)-1-(3-fluorophenyl)ethanamine
PubChem CID18070424
Molecular FormulaC14H13F2NO
Molecular Weight249.26 g/mol
Exact Mass249.10
IUPAC Name2-(2-fluorophenoxy)-1-(3-fluorophenyl)ethanamine
SMILESNC(COc1ccccc1F)c1cccc(F)c1
InChIInChI=1S/C14H13F2NO/c15-11-5-3-4-10(8-11)13(17)9-18-14-7-2-1-6-12(14)16/h1-8,13H,9,17H2
InChIKeyZMMXQCIVLTVNMP-UHFFFAOYSA-N
XLogP3.04
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.26
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-fluorophenoxy)-1-phenylethanamine
CID 16782769
2-(2-fluorophenoxy)-1-(4-fluorophenyl)ethanamine
CID 16784701
1-(3-fluorophenyl)-2-methoxyethanamine
CID 45283501
2-(3-fluoro-4-methylphenoxy)-1-(3-fluorophenyl)ethanamine
CID 107524173
2-(2,2-difluoroethoxy)-1-(3-fluorophenyl)ethanamine
CID 107523915
2-(2,3-difluorophenoxy)-1-(3-methoxyphenyl)ethanamine
CID 63036932
1-(3-fluorophenyl)-2-pyridin-3-yloxyethanamine
CID 117242787
2-(2,4-difluorophenyl)sulfanyl-1-(3-fluorophenyl)ethanamine
CID 107524316
2-(2,3-difluorophenoxy)-1-(2,4-difluorophenyl)ethanamine
CID 107523625
2-(5-bromo-2-fluorophenoxy)-1-phenylethanamine
CID 114673476
4-(2-fluorophenoxy)-2-(3-fluorophenyl)butanenitrile
CID 82137552
(1S)-2-fluoro-1-(3-fluorophenyl)ethanamine;hydrochloride
CID 171199137

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenoxy)-1-(3-fluorophenyl)ethanamine?
The IUPAC name of 2-(2-fluorophenoxy)-1-(3-fluorophenyl)ethanamine (CID 18070424) is 2-(2-fluorophenoxy)-1-(3-fluorophenyl)ethanamine.
What is the SMILES notation for 2-(2-fluorophenoxy)-1-(3-fluorophenyl)ethanamine?
The canonical SMILES for 2-(2-fluorophenoxy)-1-(3-fluorophenyl)ethanamine is NC(COc1ccccc1F)c1cccc(F)c1.
What is the InChIKey of 2-(2-fluorophenoxy)-1-(3-fluorophenyl)ethanamine?
The InChIKey is ZMMXQCIVLTVNMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13F2NO/c15-11-5-3-4-10(8-11)13(17)9-18-14-7-2-1-6-12(14)16/h1-8,13H,9,17H2.
What are the key properties of 2-(2-fluorophenoxy)-1-(3-fluorophenyl)ethanamine?
2-(2-fluorophenoxy)-1-(3-fluorophenyl)ethanamine has a molecular weight of 249.26 g/mol, XLogP of 3.04, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenoxy)-1-(3-fluorophenyl)ethanamine is sourced from PubChem (CID 18070424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).