1-(2,5-difluorophenyl)-2-(2-methylphenoxy)ethanamine

C15H15F2NO — CID 16789582

IUPAC1-(2,5-difluorophenyl)-2-(2-methylphenoxy)ethanamine
SMILESCc1ccccc1OCC(N)c1cc(F)ccc1F
InChIInChI=1S/C15H15F2NO/c1-10-4-2-3-5-15(10)19-9-14(18)12-8-11(16)6-7-13(12)17/h2-8,14H,9,18H2,1H3
InChIKeyVAIVZOMYCOUWRY-UHFFFAOYSA-N
MW263.29 g/mol
LogP3.35
Rot. Bonds4

About 1-(2,5-difluorophenyl)-2-(2-methylphenoxy)ethanamine

1-(2,5-difluorophenyl)-2-(2-methylphenoxy)ethanamine (PubChem CID 16789582) has the molecular formula C15H15F2NO and a molecular weight of 263.29 g/mol. Its IUPAC name is 1-(2,5-difluorophenyl)-2-(2-methylphenoxy)ethanamine.

Molecular Properties

Compound Name1-(2,5-difluorophenyl)-2-(2-methylphenoxy)ethanamine
PubChem CID16789582
Molecular FormulaC15H15F2NO
Molecular Weight263.29 g/mol
Exact Mass263.11
IUPAC Name1-(2,5-difluorophenyl)-2-(2-methylphenoxy)ethanamine
SMILESCc1ccccc1OCC(N)c1cc(F)ccc1F
InChIInChI=1S/C15H15F2NO/c1-10-4-2-3-5-15(10)19-9-14(18)12-8-11(16)6-7-13(12)17/h2-8,14H,9,18H2,1H3
InChIKeyVAIVZOMYCOUWRY-UHFFFAOYSA-N
XLogP3.35
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 ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(2,5-difluorophenyl)-2-(2-methylphenoxy)ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2,5-difluorophenyl)-2-(2-fluoro-3-methylphenoxy)ethanamine
CID 107657092
1-(2,4-difluorophenyl)-2-(5-fluoro-2-methylphenoxy)ethanamine
CID 107524051
2-(2-fluoro-5-methylphenoxy)-1-(2-methylphenyl)ethanamine
CID 64853630
1-(2,4-difluorophenyl)-2-(2-methoxyphenoxy)ethanamine
CID 16783272
1-(2,5-difluorophenyl)-2-(2-methylphenyl)sulfanylethanamine
CID 66096733
1-(2,5-difluorophenyl)-2-[(2-fluorophenyl)methoxy]ethanamine
CID 107523679
(1S)-2-(2-methylphenoxy)-1-phenylethanamine;hydrochloride
CID 164614673
2-(4-chlorophenoxy)-1-(4-fluoro-2-methylphenyl)ethanamine
CID 105142711
2-(2,3-difluorophenoxy)-1-(2,4-difluorophenyl)ethanamine
CID 107523625
1-(2,4-dimethylphenyl)-2-(2-fluoro-5-methylphenoxy)ethanamine
CID 64855010
2-(5-fluoro-2-methylphenoxy)-1-(2,4,6-trimethylphenyl)ethanamine
CID 102981023
1-(2,5-difluorophenyl)-3-methylbutane-1,3-diamine
CID 116933552

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-difluorophenyl)-2-(2-methylphenoxy)ethanamine?
The IUPAC name of 1-(2,5-difluorophenyl)-2-(2-methylphenoxy)ethanamine (CID 16789582) is 1-(2,5-difluorophenyl)-2-(2-methylphenoxy)ethanamine.
What is the SMILES notation for 1-(2,5-difluorophenyl)-2-(2-methylphenoxy)ethanamine?
The canonical SMILES for 1-(2,5-difluorophenyl)-2-(2-methylphenoxy)ethanamine is Cc1ccccc1OCC(N)c1cc(F)ccc1F.
What is the InChIKey of 1-(2,5-difluorophenyl)-2-(2-methylphenoxy)ethanamine?
The InChIKey is VAIVZOMYCOUWRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15F2NO/c1-10-4-2-3-5-15(10)19-9-14(18)12-8-11(16)6-7-13(12)17/h2-8,14H,9,18H2,1H3.
What are the key properties of 1-(2,5-difluorophenyl)-2-(2-methylphenoxy)ethanamine?
1-(2,5-difluorophenyl)-2-(2-methylphenoxy)ethanamine has a molecular weight of 263.29 g/mol, XLogP of 3.35, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-difluorophenyl)-2-(2-methylphenoxy)ethanamine is sourced from PubChem (CID 16789582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).