2-(2-fluoro-5-methylphenoxy)-1-(2-methylphenyl)ethanamine

C16H18FNO — CID 64853630

IUPAC2-(2-fluoro-5-methylphenoxy)-1-(2-methylphenyl)ethanamine
SMILESCc1ccc(F)c(OCC(N)c2ccccc2C)c1
InChIInChI=1S/C16H18FNO/c1-11-7-8-14(17)16(9-11)19-10-15(18)13-6-4-3-5-12(13)2/h3-9,15H,10,18H2,1-2H3
InChIKeyIOHTZPBHJMQOFY-UHFFFAOYSA-N
MW259.32 g/mol
LogP3.52
Rot. Bonds4

About 2-(2-fluoro-5-methylphenoxy)-1-(2-methylphenyl)ethanamine

2-(2-fluoro-5-methylphenoxy)-1-(2-methylphenyl)ethanamine (PubChem CID 64853630) has the molecular formula C16H18FNO and a molecular weight of 259.32 g/mol. Its IUPAC name is 2-(2-fluoro-5-methylphenoxy)-1-(2-methylphenyl)ethanamine.

Molecular Properties

Compound Name2-(2-fluoro-5-methylphenoxy)-1-(2-methylphenyl)ethanamine
PubChem CID64853630
Molecular FormulaC16H18FNO
Molecular Weight259.32 g/mol
Exact Mass259.14
IUPAC Name2-(2-fluoro-5-methylphenoxy)-1-(2-methylphenyl)ethanamine
SMILESCc1ccc(F)c(OCC(N)c2ccccc2C)c1
InChIInChI=1S/C16H18FNO/c1-11-7-8-14(17)16(9-11)19-10-15(18)13-6-4-3-5-12(13)2/h3-9,15H,10,18H2,1-2H3
InChIKeyIOHTZPBHJMQOFY-UHFFFAOYSA-N
XLogP3.52
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.32
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,4-dimethylphenyl)-2-(2-fluoro-5-methylphenoxy)ethanamine
CID 64855010
N-ethyl-2-(2-fluoro-5-methylphenoxy)-1-(2-methylphenyl)ethanamine
CID 64855007
1-(2,5-difluorophenyl)-2-(2-methylphenoxy)ethanamine
CID 16789582
1-(2-fluoro-5-methylphenoxy)-1-(2-methylphenyl)butan-2-amine
CID 64854999
2-(2-ethylphenoxy)-1-(2-methylphenyl)ethanamine
CID 43364243
1-fluoro-2-(2-fluoropropoxy)-4-methylbenzene
CID 134558934
(1R)-1-[2-(2-fluoro-5-methylphenoxy)phenyl]propan-1-amine
CID 103959407
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-aminophenoxy)-3-(2-fluoro-5-methylphenoxy)propan-2-ol
CID 64855185
2-(2,6-dimethylphenoxy)-1-(2,5-dimethylphenyl)ethanamine
CID 43093894
2-(2,3-dimethylphenoxy)-1-(2-methoxy-5-methylphenyl)ethanamine
CID 43101312

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluoro-5-methylphenoxy)-1-(2-methylphenyl)ethanamine?
The IUPAC name of 2-(2-fluoro-5-methylphenoxy)-1-(2-methylphenyl)ethanamine (CID 64853630) is 2-(2-fluoro-5-methylphenoxy)-1-(2-methylphenyl)ethanamine.
What is the SMILES notation for 2-(2-fluoro-5-methylphenoxy)-1-(2-methylphenyl)ethanamine?
The canonical SMILES for 2-(2-fluoro-5-methylphenoxy)-1-(2-methylphenyl)ethanamine is Cc1ccc(F)c(OCC(N)c2ccccc2C)c1.
What is the InChIKey of 2-(2-fluoro-5-methylphenoxy)-1-(2-methylphenyl)ethanamine?
The InChIKey is IOHTZPBHJMQOFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18FNO/c1-11-7-8-14(17)16(9-11)19-10-15(18)13-6-4-3-5-12(13)2/h3-9,15H,10,18H2,1-2H3.
What are the key properties of 2-(2-fluoro-5-methylphenoxy)-1-(2-methylphenyl)ethanamine?
2-(2-fluoro-5-methylphenoxy)-1-(2-methylphenyl)ethanamine has a molecular weight of 259.32 g/mol, XLogP of 3.52, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluoro-5-methylphenoxy)-1-(2-methylphenyl)ethanamine is sourced from PubChem (CID 64853630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).