phenyl-(2,4,6-trifluorophenyl)methanamine

C13H10F3N — CID 43198681

IUPACphenyl-(2,4,6-trifluorophenyl)methanamine
SMILESNC(c1ccccc1)c1c(F)cc(F)cc1F
InChIInChI=1S/C13H10F3N/c14-9-6-10(15)12(11(16)7-9)13(17)8-4-2-1-3-5-8/h1-7,13H,17H2
InChIKeyMVGGLKJSDBRFFK-UHFFFAOYSA-N
MW237.22 g/mol
LogP3.15
Rot. Bonds2

About phenyl-(2,4,6-trifluorophenyl)methanamine

phenyl-(2,4,6-trifluorophenyl)methanamine (PubChem CID 43198681) has the molecular formula C13H10F3N and a molecular weight of 237.22 g/mol. Its IUPAC name is phenyl-(2,4,6-trifluorophenyl)methanamine.

Molecular Properties

Compound Namephenyl-(2,4,6-trifluorophenyl)methanamine
PubChem CID43198681
Molecular FormulaC13H10F3N
Molecular Weight237.22 g/mol
Exact Mass237.08
IUPAC Namephenyl-(2,4,6-trifluorophenyl)methanamine
SMILESNC(c1ccccc1)c1c(F)cc(F)cc1F
InChIInChI=1S/C13H10F3N/c14-9-6-10(15)12(11(16)7-9)13(17)8-4-2-1-3-5-8/h1-7,13H,17H2
InChIKeyMVGGLKJSDBRFFK-UHFFFAOYSA-N
XLogP3.15
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.22
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(4-propan-2-ylphenyl)-(2,4,6-trifluorophenyl)methanamine
CID 43198710
(4-iodophenyl)-(2,4,6-trifluorophenyl)methanamine
CID 43124899
(4-butan-2-ylphenyl)-(2,4,6-trifluorophenyl)methanamine
CID 65101153
quinolin-3-yl-(2,4,6-trifluorophenyl)methanamine
CID 115798580
(2-iodophenyl)-(2,4,6-trifluorophenyl)methanamine
CID 43198713
(4-fluorophenyl)-phenylmethanamine
CID 11183272
2,3-dihydro-1H-inden-5-yl-(2,4,6-trifluorophenyl)methanamine
CID 43198708
(5-bromothiophen-3-yl)-(2,4,6-trifluorophenyl)methanamine
CID 107960534
(2-bromo-6-fluorophenyl)-(2,4,6-trifluorophenyl)methanamine
CID 114558834
(5-fluoro-1-benzothiophen-2-yl)-phenylmethanamine
CID 105083659
(3-bromo-5-methylphenyl)-(2,4,6-trifluorophenyl)methanamine
CID 104851108
(2-chloro-4-fluorophenyl)-(2,4,6-trifluorophenyl)methanamine
CID 43198689

Frequently Asked Questions

What is the IUPAC name of phenyl-(2,4,6-trifluorophenyl)methanamine?
The IUPAC name of phenyl-(2,4,6-trifluorophenyl)methanamine (CID 43198681) is phenyl-(2,4,6-trifluorophenyl)methanamine.
What is the SMILES notation for phenyl-(2,4,6-trifluorophenyl)methanamine?
The canonical SMILES for phenyl-(2,4,6-trifluorophenyl)methanamine is NC(c1ccccc1)c1c(F)cc(F)cc1F.
What is the InChIKey of phenyl-(2,4,6-trifluorophenyl)methanamine?
The InChIKey is MVGGLKJSDBRFFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10F3N/c14-9-6-10(15)12(11(16)7-9)13(17)8-4-2-1-3-5-8/h1-7,13H,17H2.
What are the key properties of phenyl-(2,4,6-trifluorophenyl)methanamine?
phenyl-(2,4,6-trifluorophenyl)methanamine has a molecular weight of 237.22 g/mol, XLogP of 3.15, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl-(2,4,6-trifluorophenyl)methanamine is sourced from PubChem (CID 43198681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).