N,N-dimethyl-4-phenyl-3-(trifluoromethyl)aniline

C15H14F3N — CID 11680544

IUPACN,N-dimethyl-4-phenyl-3-(trifluoromethyl)aniline
SMILESCN(C)c1ccc(-c2ccccc2)c(C(F)(F)F)c1
InChIInChI=1S/C15H14F3N/c1-19(2)12-8-9-13(11-6-4-3-5-7-11)14(10-12)15(16,17)18/h3-10H,1-2H3
InChIKeyQSMMUOYSJBJUQZ-UHFFFAOYSA-N
MW265.28 g/mol
LogP4.44
Rot. Bonds2

About N,N-dimethyl-4-phenyl-3-(trifluoromethyl)aniline

N,N-dimethyl-4-phenyl-3-(trifluoromethyl)aniline (PubChem CID 11680544) has the molecular formula C15H14F3N and a molecular weight of 265.28 g/mol. Its IUPAC name is N,N-dimethyl-4-phenyl-3-(trifluoromethyl)aniline.

Molecular Properties

Compound NameN,N-dimethyl-4-phenyl-3-(trifluoromethyl)aniline
PubChem CID11680544
Molecular FormulaC15H14F3N
Molecular Weight265.28 g/mol
Exact Mass265.11
IUPAC NameN,N-dimethyl-4-phenyl-3-(trifluoromethyl)aniline
SMILESCN(C)c1ccc(-c2ccccc2)c(C(F)(F)F)c1
InChIInChI=1S/C15H14F3N/c1-19(2)12-8-9-13(11-6-4-3-5-7-11)14(10-12)15(16,17)18/h3-10H,1-2H3
InChIKeyQSMMUOYSJBJUQZ-UHFFFAOYSA-N
XLogP4.44
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.28
LogP ≤ 54.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-phenyl-3-(trifluoromethyl)aniline?
The IUPAC name of N,N-dimethyl-4-phenyl-3-(trifluoromethyl)aniline (CID 11680544) is N,N-dimethyl-4-phenyl-3-(trifluoromethyl)aniline.
What is the SMILES notation for N,N-dimethyl-4-phenyl-3-(trifluoromethyl)aniline?
The canonical SMILES for N,N-dimethyl-4-phenyl-3-(trifluoromethyl)aniline is CN(C)c1ccc(-c2ccccc2)c(C(F)(F)F)c1.
What is the InChIKey of N,N-dimethyl-4-phenyl-3-(trifluoromethyl)aniline?
The InChIKey is QSMMUOYSJBJUQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F3N/c1-19(2)12-8-9-13(11-6-4-3-5-7-11)14(10-12)15(16,17)18/h3-10H,1-2H3.
What are the key properties of N,N-dimethyl-4-phenyl-3-(trifluoromethyl)aniline?
N,N-dimethyl-4-phenyl-3-(trifluoromethyl)aniline has a molecular weight of 265.28 g/mol, XLogP of 4.44, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-phenyl-3-(trifluoromethyl)aniline is sourced from PubChem (CID 11680544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).