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

C14H12F3N — CID 46315138

IUPAC[2-phenyl-3-(trifluoromethyl)phenyl]methanamine
SMILESNCc1cccc(C(F)(F)F)c1-c1ccccc1
InChIInChI=1S/C14H12F3N/c15-14(16,17)12-8-4-7-11(9-18)13(12)10-5-2-1-3-6-10/h1-8H,9,18H2
InChIKeyFQRVWDMNGBNRTJ-UHFFFAOYSA-N
MW251.25 g/mol
LogP3.83
Rot. Bonds2

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

[2-phenyl-3-(trifluoromethyl)phenyl]methanamine (PubChem CID 46315138) has the molecular formula C14H12F3N and a molecular weight of 251.25 g/mol. Its IUPAC name is [2-phenyl-3-(trifluoromethyl)phenyl]methanamine.

Molecular Properties

Compound Name[2-phenyl-3-(trifluoromethyl)phenyl]methanamine
PubChem CID46315138
Molecular FormulaC14H12F3N
Molecular Weight251.25 g/mol
Exact Mass251.09
IUPAC Name[2-phenyl-3-(trifluoromethyl)phenyl]methanamine
SMILESNCc1cccc(C(F)(F)F)c1-c1ccccc1
InChIInChI=1S/C14H12F3N/c15-14(16,17)12-8-4-7-11(9-18)13(12)10-5-2-1-3-6-10/h1-8H,9,18H2
InChIKeyFQRVWDMNGBNRTJ-UHFFFAOYSA-N
XLogP3.83
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.25
LogP ≤ 53.83
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-(2-fluorophenyl)-3-(trifluoromethyl)phenyl]methanamine
CID 46313291
[2-fluoro-3-[2-(trifluoromethyl)phenyl]phenyl]methanamine
CID 134631455
[2-bromo-3-(trifluoromethyl)phenyl]methanamine;hydrochloride
CID 70700248
2-[2-(2-aminoethoxy)ethoxy]ethanamine;[2-(trifluoromethyl)phenyl]methanamine
CID 70118459
2-(aminomethyl)-6-(trifluoromethyl)benzonitrile
CID 86617537
2,2,2-trifluoroacetic acid;[2-[2-(trifluoromethyl)phenyl]phenyl]methanamine
CID 162318731
1-(trifluoromethyl)-2-[2-[2-(trifluoromethyl)phenyl]ethyl]benzene
CID 2773232
3-(bromomethyl)-4-phenyl-5-(trifluoromethyl)pyridine
CID 133098043
[2-bromo-3-(trifluoromethyl)phenyl]methanamine;formic acid
CID 174979218
1,3-bis(trifluoromethyl)-2-[4-(trifluoromethyl)phenyl]benzene
CID 119000485
[2-bromo-6-(trifluoromethyl)phenyl]methanamine;hydrochloride
CID 119018838

Frequently Asked Questions

What is the IUPAC name of [2-phenyl-3-(trifluoromethyl)phenyl]methanamine?
The IUPAC name of [2-phenyl-3-(trifluoromethyl)phenyl]methanamine (CID 46315138) is [2-phenyl-3-(trifluoromethyl)phenyl]methanamine.
What is the SMILES notation for [2-phenyl-3-(trifluoromethyl)phenyl]methanamine?
The canonical SMILES for [2-phenyl-3-(trifluoromethyl)phenyl]methanamine is NCc1cccc(C(F)(F)F)c1-c1ccccc1.
What is the InChIKey of [2-phenyl-3-(trifluoromethyl)phenyl]methanamine?
The InChIKey is FQRVWDMNGBNRTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12F3N/c15-14(16,17)12-8-4-7-11(9-18)13(12)10-5-2-1-3-6-10/h1-8H,9,18H2.
What are the key properties of [2-phenyl-3-(trifluoromethyl)phenyl]methanamine?
[2-phenyl-3-(trifluoromethyl)phenyl]methanamine has a molecular weight of 251.25 g/mol, XLogP of 3.83, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [2-phenyl-3-(trifluoromethyl)phenyl]methanamine is sourced from PubChem (CID 46315138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).