[2-(2-fluorophenyl)-3-(trifluoromethyl)phenyl]methanamine

C14H11F4N — CID 46313291

IUPAC[2-(2-fluorophenyl)-3-(trifluoromethyl)phenyl]methanamine
SMILESNCc1cccc(C(F)(F)F)c1-c1ccccc1F
InChIInChI=1S/C14H11F4N/c15-12-7-2-1-5-10(12)13-9(8-19)4-3-6-11(13)14(16,17)18/h1-7H,8,19H2
InChIKeyZQPKPVYOTOZZPJ-UHFFFAOYSA-N
MW269.24 g/mol
LogP3.97
Rot. Bonds2

About [2-(2-fluorophenyl)-3-(trifluoromethyl)phenyl]methanamine

[2-(2-fluorophenyl)-3-(trifluoromethyl)phenyl]methanamine (PubChem CID 46313291) has the molecular formula C14H11F4N and a molecular weight of 269.24 g/mol. Its IUPAC name is [2-(2-fluorophenyl)-3-(trifluoromethyl)phenyl]methanamine.

Molecular Properties

Compound Name[2-(2-fluorophenyl)-3-(trifluoromethyl)phenyl]methanamine
PubChem CID46313291
Molecular FormulaC14H11F4N
Molecular Weight269.24 g/mol
Exact Mass269.08
IUPAC Name[2-(2-fluorophenyl)-3-(trifluoromethyl)phenyl]methanamine
SMILESNCc1cccc(C(F)(F)F)c1-c1ccccc1F
InChIInChI=1S/C14H11F4N/c15-12-7-2-1-5-10(12)13-9(8-19)4-3-6-11(13)14(16,17)18/h1-7H,8,19H2
InChIKeyZQPKPVYOTOZZPJ-UHFFFAOYSA-N
XLogP3.97
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.24
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[3-(trifluoromethyl)-2-[2-(trifluoromethyl)phenyl]phenyl]methanamine
CID 134631566
[2-phenyl-3-(trifluoromethyl)phenyl]methanamine
CID 46315138
[2-fluoro-3-[2-(trifluoromethyl)phenyl]phenyl]methanamine
CID 134631455
1,3-difluoro-2-[2-(trifluoromethyl)phenyl]benzene
CID 118991852
2-[2-[2-(trifluoromethoxy)phenyl]-3-(trifluoromethyl)phenyl]ethanamine
CID 118854667
2-[2-(2-aminoethoxy)ethoxy]ethanamine;[2-(trifluoromethyl)phenyl]methanamine
CID 70118459
[2-bromo-3-(trifluoromethyl)phenyl]methanamine;hydrochloride
CID 70700248
1,2-difluoro-3-[2-methyl-6-(trifluoromethyl)phenyl]benzene
CID 118843388
2,2,2-trifluoroacetic acid;[2-[2-(trifluoromethyl)phenyl]phenyl]methanamine
CID 162318731
(2,3-difluorophenyl)methanamine
CID 2736941
N-[(2,6-difluorophenyl)methyl]-1-[2-(trifluoromethyl)phenyl]methanamine
CID 62049514
3-[2-(2-fluorophenyl)-3-(trifluoromethyl)phenyl]prop-2-enoic acid
CID 75177372

Frequently Asked Questions

What is the IUPAC name of [2-(2-fluorophenyl)-3-(trifluoromethyl)phenyl]methanamine?
The IUPAC name of [2-(2-fluorophenyl)-3-(trifluoromethyl)phenyl]methanamine (CID 46313291) is [2-(2-fluorophenyl)-3-(trifluoromethyl)phenyl]methanamine.
What is the SMILES notation for [2-(2-fluorophenyl)-3-(trifluoromethyl)phenyl]methanamine?
The canonical SMILES for [2-(2-fluorophenyl)-3-(trifluoromethyl)phenyl]methanamine is NCc1cccc(C(F)(F)F)c1-c1ccccc1F.
What is the InChIKey of [2-(2-fluorophenyl)-3-(trifluoromethyl)phenyl]methanamine?
The InChIKey is ZQPKPVYOTOZZPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11F4N/c15-12-7-2-1-5-10(12)13-9(8-19)4-3-6-11(13)14(16,17)18/h1-7H,8,19H2.
What are the key properties of [2-(2-fluorophenyl)-3-(trifluoromethyl)phenyl]methanamine?
[2-(2-fluorophenyl)-3-(trifluoromethyl)phenyl]methanamine has a molecular weight of 269.24 g/mol, XLogP of 3.97, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-fluorophenyl)-3-(trifluoromethyl)phenyl]methanamine is sourced from PubChem (CID 46313291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).