2-(4-fluorophenyl)-2-(2-methoxy-5-methylphenyl)ethanamine

C16H18FNO — CID 82023273

IUPAC2-(4-fluorophenyl)-2-(2-methoxy-5-methylphenyl)ethanamine
SMILESCOc1ccc(C)cc1C(CN)c1ccc(F)cc1
InChIInChI=1S/C16H18FNO/c1-11-3-8-16(19-2)14(9-11)15(10-18)12-4-6-13(17)7-5-12/h3-9,15H,10,18H2,1-2H3
InChIKeyYDPDOSOCDKEGER-UHFFFAOYSA-N
MW259.32 g/mol
LogP3.23
Rot. Bonds4

About 2-(4-fluorophenyl)-2-(2-methoxy-5-methylphenyl)ethanamine

2-(4-fluorophenyl)-2-(2-methoxy-5-methylphenyl)ethanamine (PubChem CID 82023273) has the molecular formula C16H18FNO and a molecular weight of 259.32 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-2-(2-methoxy-5-methylphenyl)ethanamine.

Molecular Properties

Compound Name2-(4-fluorophenyl)-2-(2-methoxy-5-methylphenyl)ethanamine
PubChem CID82023273
Molecular FormulaC16H18FNO
Molecular Weight259.32 g/mol
Exact Mass259.14
IUPAC Name2-(4-fluorophenyl)-2-(2-methoxy-5-methylphenyl)ethanamine
SMILESCOc1ccc(C)cc1C(CN)c1ccc(F)cc1
InChIInChI=1S/C16H18FNO/c1-11-3-8-16(19-2)14(9-11)15(10-18)12-4-6-13(17)7-5-12/h3-9,15H,10,18H2,1-2H3
InChIKeyYDPDOSOCDKEGER-UHFFFAOYSA-N
XLogP3.23
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 ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-fluoro-2-methylphenyl)-1-(2-methoxy-5-methylphenyl)ethanamine
CID 105050993
2-(4-fluorophenyl)-2-(4-methoxyphenyl)ethanamine
CID 82023270
2-(2-methoxy-5-methylphenyl)-2-(3-propan-2-yl-1H-pyrazol-5-yl)ethanamine
CID 83986997
2-[fluoro-(2-methoxy-5-methylphenyl)methyl]-3-methylbutan-1-amine
CID 107443810
(3-fluoro-4-methoxyphenyl)-(2-methoxy-5-methylphenyl)methanamine
CID 62505966
2-(5-chloro-2-methoxyphenyl)-2-phenylethanamine
CID 82501011
2-(2-bromo-5-fluorophenyl)-1-(2-methoxy-5-methylphenyl)ethanamine
CID 115843576
2-(3,4-dimethylphenyl)-2-(4-fluorophenyl)ethanamine
CID 82023265
1-(2-methoxy-5-methylphenyl)-2-methylpropane-1,3-diamine
CID 116933048
1-(2-methoxy-5-methylphenyl)-N,N-dimethylethane-1,2-diamine
CID 82283769
2-(4-chlorophenyl)-2-(2-methoxyphenyl)ethanamine
CID 82023303
(3,4-dimethoxyphenyl)-(2-fluoro-5-methylphenyl)methanamine
CID 62514449

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-2-(2-methoxy-5-methylphenyl)ethanamine?
The IUPAC name of 2-(4-fluorophenyl)-2-(2-methoxy-5-methylphenyl)ethanamine (CID 82023273) is 2-(4-fluorophenyl)-2-(2-methoxy-5-methylphenyl)ethanamine.
What is the SMILES notation for 2-(4-fluorophenyl)-2-(2-methoxy-5-methylphenyl)ethanamine?
The canonical SMILES for 2-(4-fluorophenyl)-2-(2-methoxy-5-methylphenyl)ethanamine is COc1ccc(C)cc1C(CN)c1ccc(F)cc1.
What is the InChIKey of 2-(4-fluorophenyl)-2-(2-methoxy-5-methylphenyl)ethanamine?
The InChIKey is YDPDOSOCDKEGER-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18FNO/c1-11-3-8-16(19-2)14(9-11)15(10-18)12-4-6-13(17)7-5-12/h3-9,15H,10,18H2,1-2H3.
What are the key properties of 2-(4-fluorophenyl)-2-(2-methoxy-5-methylphenyl)ethanamine?
2-(4-fluorophenyl)-2-(2-methoxy-5-methylphenyl)ethanamine has a molecular weight of 259.32 g/mol, XLogP of 3.23, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-2-(2-methoxy-5-methylphenyl)ethanamine is sourced from PubChem (CID 82023273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).