[4-(trifluoromethyl)phenyl]-(2,4,6-trimethylphenyl)methanamine

C17H18F3N — CID 43100339

IUPAC[4-(trifluoromethyl)phenyl]-(2,4,6-trimethylphenyl)methanamine
SMILESCc1cc(C)c(C(N)c2ccc(C(F)(F)F)cc2)c(C)c1
InChIInChI=1S/C17H18F3N/c1-10-8-11(2)15(12(3)9-10)16(21)13-4-6-14(7-5-13)17(18,19)20/h4-9,16H,21H2,1-3H3
InChIKeyFJEYJJJAMFWZFJ-UHFFFAOYSA-N
MW293.33 g/mol
LogP4.68
Rot. Bonds2

About [4-(trifluoromethyl)phenyl]-(2,4,6-trimethylphenyl)methanamine

[4-(trifluoromethyl)phenyl]-(2,4,6-trimethylphenyl)methanamine (PubChem CID 43100339) has the molecular formula C17H18F3N and a molecular weight of 293.33 g/mol. Its IUPAC name is [4-(trifluoromethyl)phenyl]-(2,4,6-trimethylphenyl)methanamine.

Molecular Properties

Compound Name[4-(trifluoromethyl)phenyl]-(2,4,6-trimethylphenyl)methanamine
PubChem CID43100339
Molecular FormulaC17H18F3N
Molecular Weight293.33 g/mol
Exact Mass293.14
IUPAC Name[4-(trifluoromethyl)phenyl]-(2,4,6-trimethylphenyl)methanamine
SMILESCc1cc(C)c(C(N)c2ccc(C(F)(F)F)cc2)c(C)c1
InChIInChI=1S/C17H18F3N/c1-10-8-11(2)15(12(3)9-10)16(21)13-4-6-14(7-5-13)17(18,19)20/h4-9,16H,21H2,1-3H3
InChIKeyFJEYJJJAMFWZFJ-UHFFFAOYSA-N
XLogP4.68
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.33
LogP ≤ 54.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze [4-(trifluoromethyl)phenyl]-(2,4,6-trimethylphenyl)methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(4-fluoro-2,6-dimethylphenyl)-[4-(trifluoromethyl)phenyl]methanamine
CID 106877167
(4-tert-butylphenyl)-(4-fluoro-2,6-dimethylphenyl)methanamine
CID 106877511
(2-fluoro-4,6-dimethylphenyl)-(4-propan-2-ylphenyl)methanamine
CID 106881261
(5-bromo-4-methylthiophen-2-yl)-[4-(trifluoromethyl)phenyl]methanamine
CID 79992170
(S)-[3-(trifluoromethyl)phenyl]-[4-(trifluoromethyl)phenyl]methanamine
CID 170898673
(4-methylsulfanylphenyl)-[4-(trifluoromethyl)phenyl]methanamine
CID 115852240
(S)-(3-methyl-2-pyridinyl)-[4-(trifluoromethyl)phenyl]methanamine
CID 71144422
2-[chloro-[4-(trifluoromethyl)phenyl]methyl]-5-fluoro-1,3-dimethylbenzene
CID 106879788
(6-methoxypyrimidin-4-yl)-[4-(trifluoromethyl)phenyl]methanamine
CID 102950754
(1S)-2-methyl-1-[4-(trifluoromethyl)phenyl]propan-1-amine
CID 71134587
(2-methoxy-4,6-dimethylphenyl)-(4-methoxyphenyl)methanamine
CID 106680347
1-(3,4-dimethylphenyl)-2-[4-(trifluoromethyl)phenyl]ethanamine
CID 62115577

Frequently Asked Questions

What is the IUPAC name of [4-(trifluoromethyl)phenyl]-(2,4,6-trimethylphenyl)methanamine?
The IUPAC name of [4-(trifluoromethyl)phenyl]-(2,4,6-trimethylphenyl)methanamine (CID 43100339) is [4-(trifluoromethyl)phenyl]-(2,4,6-trimethylphenyl)methanamine.
What is the SMILES notation for [4-(trifluoromethyl)phenyl]-(2,4,6-trimethylphenyl)methanamine?
The canonical SMILES for [4-(trifluoromethyl)phenyl]-(2,4,6-trimethylphenyl)methanamine is Cc1cc(C)c(C(N)c2ccc(C(F)(F)F)cc2)c(C)c1.
What is the InChIKey of [4-(trifluoromethyl)phenyl]-(2,4,6-trimethylphenyl)methanamine?
The InChIKey is FJEYJJJAMFWZFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18F3N/c1-10-8-11(2)15(12(3)9-10)16(21)13-4-6-14(7-5-13)17(18,19)20/h4-9,16H,21H2,1-3H3.
What are the key properties of [4-(trifluoromethyl)phenyl]-(2,4,6-trimethylphenyl)methanamine?
[4-(trifluoromethyl)phenyl]-(2,4,6-trimethylphenyl)methanamine has a molecular weight of 293.33 g/mol, XLogP of 4.68, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(trifluoromethyl)phenyl]-(2,4,6-trimethylphenyl)methanamine is sourced from PubChem (CID 43100339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).