2-[5-fluoro-2-(5-fluoro-2-methylphenoxy)phenyl]ethanamine

C15H15F2NO — CID 102990405

IUPAC2-[5-fluoro-2-(5-fluoro-2-methylphenoxy)phenyl]ethanamine
SMILESCc1ccc(F)cc1Oc1ccc(F)cc1CCN
InChIInChI=1S/C15H15F2NO/c1-10-2-3-13(17)9-15(10)19-14-5-4-12(16)8-11(14)6-7-18/h2-5,8-9H,6-7,18H2,1H3
InChIKeyLPFYREWEUHAZOD-UHFFFAOYSA-N
MW263.29 g/mol
LogP3.57
Rot. Bonds4

About 2-[5-fluoro-2-(5-fluoro-2-methylphenoxy)phenyl]ethanamine

2-[5-fluoro-2-(5-fluoro-2-methylphenoxy)phenyl]ethanamine (PubChem CID 102990405) has the molecular formula C15H15F2NO and a molecular weight of 263.29 g/mol. Its IUPAC name is 2-[5-fluoro-2-(5-fluoro-2-methylphenoxy)phenyl]ethanamine.

Molecular Properties

Compound Name2-[5-fluoro-2-(5-fluoro-2-methylphenoxy)phenyl]ethanamine
PubChem CID102990405
Molecular FormulaC15H15F2NO
Molecular Weight263.29 g/mol
Exact Mass263.11
IUPAC Name2-[5-fluoro-2-(5-fluoro-2-methylphenoxy)phenyl]ethanamine
SMILESCc1ccc(F)cc1Oc1ccc(F)cc1CCN
InChIInChI=1S/C15H15F2NO/c1-10-2-3-13(17)9-15(10)19-14-5-4-12(16)8-11(14)6-7-18/h2-5,8-9H,6-7,18H2,1H3
InChIKeyLPFYREWEUHAZOD-UHFFFAOYSA-N
XLogP3.57
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.29
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(chloromethyl)-4-fluoro-1-(5-fluoro-2-methylphenoxy)benzene
CID 102989965
2-[2-(4-chloro-3,5-dimethylphenoxy)-5-fluorophenyl]ethanamine
CID 63802635
2-[2-(2-bromophenoxy)-5-fluorophenyl]ethanamine
CID 63815572
2-[5-fluoro-2-(2-propan-2-ylphenoxy)phenyl]ethanamine
CID 63803297
2-[2-(4-ethylphenoxy)-5-fluorophenyl]ethanamine
CID 63817525
2-(chloromethyl)-1-(5-fluoro-2-methylphenoxy)-4-methylbenzene
CID 114054837
2-(4-fluoro-2-methoxyphenyl)ethanamine
CID 55254856
2-[2-[(5-fluoro-2-methylphenoxy)methyl]phenyl]ethanamine
CID 102986586
2-[5-chloro-2-(2-chloro-4-fluorophenoxy)phenyl]ethanamine
CID 114862601
2-[5-fluoro-2-(4-propoxyphenoxy)phenyl]ethanamine
CID 63815036
[2-(2,4-dimethylphenoxy)-5-fluorophenyl]methanamine
CID 43314141
[2-(5-bromo-2-methylphenoxy)-5-fluorophenyl]methanol
CID 107284920

Frequently Asked Questions

What is the IUPAC name of 2-[5-fluoro-2-(5-fluoro-2-methylphenoxy)phenyl]ethanamine?
The IUPAC name of 2-[5-fluoro-2-(5-fluoro-2-methylphenoxy)phenyl]ethanamine (CID 102990405) is 2-[5-fluoro-2-(5-fluoro-2-methylphenoxy)phenyl]ethanamine.
What is the SMILES notation for 2-[5-fluoro-2-(5-fluoro-2-methylphenoxy)phenyl]ethanamine?
The canonical SMILES for 2-[5-fluoro-2-(5-fluoro-2-methylphenoxy)phenyl]ethanamine is Cc1ccc(F)cc1Oc1ccc(F)cc1CCN.
What is the InChIKey of 2-[5-fluoro-2-(5-fluoro-2-methylphenoxy)phenyl]ethanamine?
The InChIKey is LPFYREWEUHAZOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15F2NO/c1-10-2-3-13(17)9-15(10)19-14-5-4-12(16)8-11(14)6-7-18/h2-5,8-9H,6-7,18H2,1H3.
What are the key properties of 2-[5-fluoro-2-(5-fluoro-2-methylphenoxy)phenyl]ethanamine?
2-[5-fluoro-2-(5-fluoro-2-methylphenoxy)phenyl]ethanamine has a molecular weight of 263.29 g/mol, XLogP of 3.57, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-fluoro-2-(5-fluoro-2-methylphenoxy)phenyl]ethanamine is sourced from PubChem (CID 102990405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).