N,2,3-trimethyl-4-(trifluoromethyl)aniline

C10H12F3N — CID 70839196

IUPACN,2,3-trimethyl-4-(trifluoromethyl)aniline
SMILESCNc1ccc(C(F)(F)F)c(C)c1C
InChIInChI=1S/C10H12F3N/c1-6-7(2)9(14-3)5-4-8(6)10(11,12)13/h4-5,14H,1-3H3
InChIKeyJCKPKLGGGUSEDT-UHFFFAOYSA-N
MW203.21 g/mol
LogP3.36
Rot. Bonds1

About N,2,3-trimethyl-4-(trifluoromethyl)aniline

N,2,3-trimethyl-4-(trifluoromethyl)aniline (PubChem CID 70839196) has the molecular formula C10H12F3N and a molecular weight of 203.21 g/mol. Its IUPAC name is N,2,3-trimethyl-4-(trifluoromethyl)aniline.

Molecular Properties

Compound NameN,2,3-trimethyl-4-(trifluoromethyl)aniline
PubChem CID70839196
Molecular FormulaC10H12F3N
Molecular Weight203.21 g/mol
Exact Mass203.09
IUPAC NameN,2,3-trimethyl-4-(trifluoromethyl)aniline
SMILESCNc1ccc(C(F)(F)F)c(C)c1C
InChIInChI=1S/C10H12F3N/c1-6-7(2)9(14-3)5-4-8(6)10(11,12)13/h4-5,14H,1-3H3
InChIKeyJCKPKLGGGUSEDT-UHFFFAOYSA-N
XLogP3.36
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.21
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-fluoro-N,2,3-trimethylaniline
CID 155403467
N-methyl-4-[4-(methylamino)-3-(trifluoromethyl)phenyl]-2-(trifluoromethyl)aniline
CID 58823062
N-[(4-aminocyclohexyl)methyl]-2,3-dimethyl-4-(trifluoromethyl)aniline
CID 59230201
4-(1,1-difluoroethyl)-N-methyl-2-(trifluoromethyl)aniline
CID 142133027
2-hydroxy-3-(methylamino)-6-(trifluoromethyl)benzaldehyde
CID 143077313
N-methyl-1-[2-methyl-3-(trifluoromethyl)phenyl]methanamine
CID 155749063
[2,3-dimethyl-4-(trifluoromethyl)phenyl]methanamine
CID 154810032
N-methyl-4-(trifluoromethyl)pyridin-3-amine
CID 67229905
1,2-dichloro-3-methyl-4-(trifluoromethyl)benzene
CID 14745915
[2-methyl-3-(trifluoromethyl)phenyl]hydrazine;hydrochloride
CID 84820116
2,3-dimethyl-1-nitro-4-(trifluoromethyl)benzene
CID 119006674
5-methyl-4-(methylamino)-2-(trifluoromethyl)benzoic acid
CID 122668430

Frequently Asked Questions

What is the IUPAC name of N,2,3-trimethyl-4-(trifluoromethyl)aniline?
The IUPAC name of N,2,3-trimethyl-4-(trifluoromethyl)aniline (CID 70839196) is N,2,3-trimethyl-4-(trifluoromethyl)aniline.
What is the SMILES notation for N,2,3-trimethyl-4-(trifluoromethyl)aniline?
The canonical SMILES for N,2,3-trimethyl-4-(trifluoromethyl)aniline is CNc1ccc(C(F)(F)F)c(C)c1C.
What is the InChIKey of N,2,3-trimethyl-4-(trifluoromethyl)aniline?
The InChIKey is JCKPKLGGGUSEDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F3N/c1-6-7(2)9(14-3)5-4-8(6)10(11,12)13/h4-5,14H,1-3H3.
What are the key properties of N,2,3-trimethyl-4-(trifluoromethyl)aniline?
N,2,3-trimethyl-4-(trifluoromethyl)aniline has a molecular weight of 203.21 g/mol, XLogP of 3.36, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,3-trimethyl-4-(trifluoromethyl)aniline is sourced from PubChem (CID 70839196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).