2-(4-methylphenyl)-1-(2,4,6-trifluorophenyl)ethanamine

C15H14F3N — CID 43330154

IUPAC2-(4-methylphenyl)-1-(2,4,6-trifluorophenyl)ethanamine
SMILESCc1ccc(CC(N)c2c(F)cc(F)cc2F)cc1
InChIInChI=1S/C15H14F3N/c1-9-2-4-10(5-3-9)6-14(19)15-12(17)7-11(16)8-13(15)18/h2-5,7-8,14H,6,19H2,1H3
InChIKeyUNXVWWHQMNIMCS-UHFFFAOYSA-N
MW265.28 g/mol
LogP3.65
Rot. Bonds3

About 2-(4-methylphenyl)-1-(2,4,6-trifluorophenyl)ethanamine

2-(4-methylphenyl)-1-(2,4,6-trifluorophenyl)ethanamine (PubChem CID 43330154) has the molecular formula C15H14F3N and a molecular weight of 265.28 g/mol. Its IUPAC name is 2-(4-methylphenyl)-1-(2,4,6-trifluorophenyl)ethanamine.

Molecular Properties

Compound Name2-(4-methylphenyl)-1-(2,4,6-trifluorophenyl)ethanamine
PubChem CID43330154
Molecular FormulaC15H14F3N
Molecular Weight265.28 g/mol
Exact Mass265.11
IUPAC Name2-(4-methylphenyl)-1-(2,4,6-trifluorophenyl)ethanamine
SMILESCc1ccc(CC(N)c2c(F)cc(F)cc2F)cc1
InChIInChI=1S/C15H14F3N/c1-9-2-4-10(5-3-9)6-14(19)15-12(17)7-11(16)8-13(15)18/h2-5,7-8,14H,6,19H2,1H3
InChIKeyUNXVWWHQMNIMCS-UHFFFAOYSA-N
XLogP3.65
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.28
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(4-bromophenyl)-1-(2,4,6-trifluorophenyl)ethanamine
CID 43198672
2-(3-fluoro-4-methoxyphenyl)-1-(2,4,6-trifluorophenyl)ethanamine
CID 115829866
2-(2-chloro-4-methylphenyl)-1-(2,4,6-trifluorophenyl)ethanamine
CID 106866965
N-ethyl-2-(4-methylphenyl)-1-(2,4,6-trifluorophenyl)ethanamine
CID 43490356
1-(4-bromo-2,6-difluorophenyl)-2-(4-ethylphenyl)ethanamine
CID 115803938
2-(4-bromophenyl)-1-(4-fluoro-2,6-dimethylphenyl)ethanamine
CID 106877345
2-(furan-3-yl)-1-(2,4,6-trifluorophenyl)ethanamine
CID 105030125
2-(3-bromo-5-fluorophenyl)-1-(2,4,6-trifluorophenyl)ethanamine
CID 105015725
1-(2,6-difluoro-3-methylphenyl)-2-(4-fluorophenyl)ethanamine
CID 82814538
1-(4-fluoro-2,6-dimethylphenyl)-2-(4-methoxyphenyl)ethanamine
CID 106877505
1-(4-chloro-2,5-difluorophenyl)-2-(4-methylphenyl)ethanamine
CID 82772910
2-(4-bromophenyl)-1-(2,6-difluoro-4-methoxyphenyl)ethanamine
CID 60964951

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylphenyl)-1-(2,4,6-trifluorophenyl)ethanamine?
The IUPAC name of 2-(4-methylphenyl)-1-(2,4,6-trifluorophenyl)ethanamine (CID 43330154) is 2-(4-methylphenyl)-1-(2,4,6-trifluorophenyl)ethanamine.
What is the SMILES notation for 2-(4-methylphenyl)-1-(2,4,6-trifluorophenyl)ethanamine?
The canonical SMILES for 2-(4-methylphenyl)-1-(2,4,6-trifluorophenyl)ethanamine is Cc1ccc(CC(N)c2c(F)cc(F)cc2F)cc1.
What is the InChIKey of 2-(4-methylphenyl)-1-(2,4,6-trifluorophenyl)ethanamine?
The InChIKey is UNXVWWHQMNIMCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F3N/c1-9-2-4-10(5-3-9)6-14(19)15-12(17)7-11(16)8-13(15)18/h2-5,7-8,14H,6,19H2,1H3.
What are the key properties of 2-(4-methylphenyl)-1-(2,4,6-trifluorophenyl)ethanamine?
2-(4-methylphenyl)-1-(2,4,6-trifluorophenyl)ethanamine has a molecular weight of 265.28 g/mol, XLogP of 3.65, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylphenyl)-1-(2,4,6-trifluorophenyl)ethanamine is sourced from PubChem (CID 43330154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).