2-[(2-fluorophenyl)methoxy]-1-(4-methylphenyl)ethanamine

C16H18FNO — CID 63936123

IUPAC2-[(2-fluorophenyl)methoxy]-1-(4-methylphenyl)ethanamine
SMILESCc1ccc(C(N)COCc2ccccc2F)cc1
InChIInChI=1S/C16H18FNO/c1-12-6-8-13(9-7-12)16(18)11-19-10-14-4-2-3-5-15(14)17/h2-9,16H,10-11,18H2,1H3
InChIKeyMYQHMIQCSNVYEP-UHFFFAOYSA-N
MW259.32 g/mol
LogP3.35
Rot. Bonds5

About 2-[(2-fluorophenyl)methoxy]-1-(4-methylphenyl)ethanamine

2-[(2-fluorophenyl)methoxy]-1-(4-methylphenyl)ethanamine (PubChem CID 63936123) has the molecular formula C16H18FNO and a molecular weight of 259.32 g/mol. Its IUPAC name is 2-[(2-fluorophenyl)methoxy]-1-(4-methylphenyl)ethanamine.

Molecular Properties

Compound Name2-[(2-fluorophenyl)methoxy]-1-(4-methylphenyl)ethanamine
PubChem CID63936123
Molecular FormulaC16H18FNO
Molecular Weight259.32 g/mol
Exact Mass259.14
IUPAC Name2-[(2-fluorophenyl)methoxy]-1-(4-methylphenyl)ethanamine
SMILESCc1ccc(C(N)COCc2ccccc2F)cc1
InChIInChI=1S/C16H18FNO/c1-12-6-8-13(9-7-12)16(18)11-19-10-14-4-2-3-5-15(14)17/h2-9,16H,10-11,18H2,1H3
InChIKeyMYQHMIQCSNVYEP-UHFFFAOYSA-N
XLogP3.35
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.32
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(2-fluorophenyl)methoxy]-1-(4-methoxyphenyl)ethanamine
CID 63932424
1-(2,4-dimethylphenyl)-2-[(2-fluorophenyl)methoxy]ethanamine
CID 63932433
1-fluoro-2-[(2-fluorophenyl)methoxymethyl]benzene
CID 67509440
1-(2,5-difluorophenyl)-2-[(2-fluorophenyl)methoxy]ethanamine
CID 107523679
1-fluoro-2-(2-methylbutoxymethyl)benzene
CID 91704394
2-[(2-fluorophenyl)methoxy]-1-(4-methylphenyl)propan-1-ol
CID 63935953
2-[(2-fluorophenyl)methoxy]-1-phenylethanol
CID 63937773
1-[2-(bromomethyl)butoxymethyl]-2-fluorobenzene
CID 65000075
1-(3-aminophenyl)-2-[(2-fluorophenyl)methoxy]ethanol
CID 63932629
(2-fluorophenyl)methyl 3-amino-3-phenylpropanoate
CID 63933223
1-[(2-fluorophenyl)methoxy]-3-(2-methoxy-4-methylphenoxy)propan-2-ol
CID 109414144
(1S)-1-(4-methylphenyl)propan-1-amine
CID 7028357

Frequently Asked Questions

What is the IUPAC name of 2-[(2-fluorophenyl)methoxy]-1-(4-methylphenyl)ethanamine?
The IUPAC name of 2-[(2-fluorophenyl)methoxy]-1-(4-methylphenyl)ethanamine (CID 63936123) is 2-[(2-fluorophenyl)methoxy]-1-(4-methylphenyl)ethanamine.
What is the SMILES notation for 2-[(2-fluorophenyl)methoxy]-1-(4-methylphenyl)ethanamine?
The canonical SMILES for 2-[(2-fluorophenyl)methoxy]-1-(4-methylphenyl)ethanamine is Cc1ccc(C(N)COCc2ccccc2F)cc1.
What is the InChIKey of 2-[(2-fluorophenyl)methoxy]-1-(4-methylphenyl)ethanamine?
The InChIKey is MYQHMIQCSNVYEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18FNO/c1-12-6-8-13(9-7-12)16(18)11-19-10-14-4-2-3-5-15(14)17/h2-9,16H,10-11,18H2,1H3.
What are the key properties of 2-[(2-fluorophenyl)methoxy]-1-(4-methylphenyl)ethanamine?
2-[(2-fluorophenyl)methoxy]-1-(4-methylphenyl)ethanamine has a molecular weight of 259.32 g/mol, XLogP of 3.35, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-fluorophenyl)methoxy]-1-(4-methylphenyl)ethanamine is sourced from PubChem (CID 63936123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).