1,5-dimethyl-2-[2-[4-methyl-2-(trifluoromethyl)phenyl]ethyl]-4-(trifluoromethyl)benzene

C19H18F6 — CID 178094540

IUPAC1,5-dimethyl-2-[2-[4-methyl-2-(trifluoromethyl)phenyl]ethyl]-4-(trifluoromethyl)benzene
SMILESCc1ccc(CCc2cc(C(F)(F)F)c(C)cc2C)c(C(F)(F)F)c1
InChIInChI=1S/C19H18F6/c1-11-4-5-14(17(8-11)19(23,24)25)6-7-15-10-16(18(20,21)22)13(3)9-12(15)2/h4-5,8-10H,6-7H2,1-3H3
InChIKeyLUASAUFFVUCXAK-UHFFFAOYSA-N
MW360.34 g/mol
LogP6.43
Rot. Bonds3

About 1,5-dimethyl-2-[2-[4-methyl-2-(trifluoromethyl)phenyl]ethyl]-4-(trifluoromethyl)benzene

1,5-dimethyl-2-[2-[4-methyl-2-(trifluoromethyl)phenyl]ethyl]-4-(trifluoromethyl)benzene (PubChem CID 178094540) has the molecular formula C19H18F6 and a molecular weight of 360.34 g/mol. Its IUPAC name is 1,5-dimethyl-2-[2-[4-methyl-2-(trifluoromethyl)phenyl]ethyl]-4-(trifluoromethyl)benzene.

Molecular Properties

Compound Name1,5-dimethyl-2-[2-[4-methyl-2-(trifluoromethyl)phenyl]ethyl]-4-(trifluoromethyl)benzene
PubChem CID178094540
Molecular FormulaC19H18F6
Molecular Weight360.34 g/mol
Exact Mass360.13
IUPAC Name1,5-dimethyl-2-[2-[4-methyl-2-(trifluoromethyl)phenyl]ethyl]-4-(trifluoromethyl)benzene
SMILESCc1ccc(CCc2cc(C(F)(F)F)c(C)cc2C)c(C(F)(F)F)c1
InChIInChI=1S/C19H18F6/c1-11-4-5-14(17(8-11)19(23,24)25)6-7-15-10-16(18(20,21)22)13(3)9-12(15)2/h4-5,8-10H,6-7H2,1-3H3
InChIKeyLUASAUFFVUCXAK-UHFFFAOYSA-N
XLogP6.43
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500360.34
LogP ≤ 56.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1,5-dimethyl-2-[2-[4-methyl-2-(trifluoromethyl)phenyl]ethyl]-4-(trifluoromethyl)benzene 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

1-(fluoromethyl)-4-methyl-2-(trifluoromethyl)benzene
CID 91883597
N,N-dimethyl-2-[4-methyl-2-(trifluoromethyl)phenyl]acetamide
CID 171089642
1-methyl-2-[2-[2-methyl-4-(trifluoromethyl)phenyl]ethyl]-4-(trifluoromethyl)benzene
CID 123542451
1,2-dimethyl-5-[2-[4-methyl-2-(trifluoromethyl)phenyl]ethyl]pyrrolidine
CID 145097309
2-ethyl-4-methyl-1-(trifluoromethyl)benzene
CID 89088576
2,4-dimethyl-1-[4-methyl-2-(trifluoromethyl)phenyl]benzene
CID 20697245
4-methyl-2-(trifluoromethyl)aniline
CID 2737710
1-ethyl-2-methyl-4,5-bis(trifluoromethyl)benzene
CID 135742868
1,2-dimethyl-3-(trifluoromethyl)benzene;1,4-dimethyl-2-(trifluoromethyl)benzene;ethane
CID 165397677
1,2-dimethyl-4-[[2-methyl-4-(trifluoromethyl)phenyl]methyl]-5-(trifluoromethyl)benzene
CID 143655992
ethane;4-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]morpholine
CID 144816585
4-methyl-1-[[4-methyl-2-(trifluoromethyl)phenyl]methyl]piperazin-2-one
CID 144622856

Frequently Asked Questions

What is the IUPAC name of 1,5-dimethyl-2-[2-[4-methyl-2-(trifluoromethyl)phenyl]ethyl]-4-(trifluoromethyl)benzene?
The IUPAC name of 1,5-dimethyl-2-[2-[4-methyl-2-(trifluoromethyl)phenyl]ethyl]-4-(trifluoromethyl)benzene (CID 178094540) is 1,5-dimethyl-2-[2-[4-methyl-2-(trifluoromethyl)phenyl]ethyl]-4-(trifluoromethyl)benzene.
What is the SMILES notation for 1,5-dimethyl-2-[2-[4-methyl-2-(trifluoromethyl)phenyl]ethyl]-4-(trifluoromethyl)benzene?
The canonical SMILES for 1,5-dimethyl-2-[2-[4-methyl-2-(trifluoromethyl)phenyl]ethyl]-4-(trifluoromethyl)benzene is Cc1ccc(CCc2cc(C(F)(F)F)c(C)cc2C)c(C(F)(F)F)c1.
What is the InChIKey of 1,5-dimethyl-2-[2-[4-methyl-2-(trifluoromethyl)phenyl]ethyl]-4-(trifluoromethyl)benzene?
The InChIKey is LUASAUFFVUCXAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18F6/c1-11-4-5-14(17(8-11)19(23,24)25)6-7-15-10-16(18(20,21)22)13(3)9-12(15)2/h4-5,8-10H,6-7H2,1-3H3.
What are the key properties of 1,5-dimethyl-2-[2-[4-methyl-2-(trifluoromethyl)phenyl]ethyl]-4-(trifluoromethyl)benzene?
1,5-dimethyl-2-[2-[4-methyl-2-(trifluoromethyl)phenyl]ethyl]-4-(trifluoromethyl)benzene has a molecular weight of 360.34 g/mol, XLogP of 6.43, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethyl-2-[2-[4-methyl-2-(trifluoromethyl)phenyl]ethyl]-4-(trifluoromethyl)benzene is sourced from PubChem (CID 178094540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).