1-methyl-5-[4-(trifluoromethoxy)phenyl]imidazole

C11H9F3N2O — CID 134354899

IUPAC1-methyl-5-[4-(trifluoromethoxy)phenyl]imidazole
SMILESCn1cncc1-c1ccc(OC(F)(F)F)cc1
InChIInChI=1S/C11H9F3N2O/c1-16-7-15-6-10(16)8-2-4-9(5-3-8)17-11(12,13)14/h2-7H,1H3
InChIKeyQGVLFQLDCWEPIR-UHFFFAOYSA-N
MW242.20 g/mol
LogP2.99
Rot. Bonds2

About 1-methyl-5-[4-(trifluoromethoxy)phenyl]imidazole

1-methyl-5-[4-(trifluoromethoxy)phenyl]imidazole (PubChem CID 134354899) has the molecular formula C11H9F3N2O and a molecular weight of 242.20 g/mol. Its IUPAC name is 1-methyl-5-[4-(trifluoromethoxy)phenyl]imidazole.

Molecular Properties

Compound Name1-methyl-5-[4-(trifluoromethoxy)phenyl]imidazole
PubChem CID134354899
Molecular FormulaC11H9F3N2O
Molecular Weight242.20 g/mol
Exact Mass242.07
IUPAC Name1-methyl-5-[4-(trifluoromethoxy)phenyl]imidazole
SMILESCn1cncc1-c1ccc(OC(F)(F)F)cc1
InChIInChI=1S/C11H9F3N2O/c1-16-7-15-6-10(16)8-2-4-9(5-3-8)17-11(12,13)14/h2-7H,1H3
InChIKeyQGVLFQLDCWEPIR-UHFFFAOYSA-N
XLogP2.99
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.20
LogP ≤ 52.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-methyl-5-[4-(trifluoromethoxy)phenyl]imidazole 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-propan-2-yl-5-[4-(trifluoromethoxy)phenyl]imidazole
CID 165482366
2-[5-[4-(trifluoromethoxy)phenyl]imidazol-1-yl]pyridine
CID 174688521
N-methyl-4-(3-methylimidazol-4-yl)aniline
CID 154953693
1-propan-2-yl-2-[4-(trifluoromethoxy)phenyl]pyrrolo[2,3-c]pyridine
CID 146619131
2-[4-(trifluoromethoxy)phenyl]pyrazine
CID 91219772
2-bromo-7-[4-(trifluoromethoxy)phenyl]pyrrolo[2,1-f][1,2,4]triazine
CID 172551718
methane;1-methyl-4-(trifluoromethoxy)benzene
CID 160675977
(3-methylimidazol-4-yl)-[3-(trifluoromethoxy)phenyl]methanol
CID 66118408
2-methyl-1-(pyridin-3-ylmethyl)-5-[4-(trifluoromethoxy)phenyl]pyrrole-3-carboxylic acid
CID 56670245
2-[4-(trifluoromethoxy)phenyl]-1H-pyrrolo[2,3-c]pyridine
CID 146619016
methanamine;1-methyl-4-(trifluoromethoxy)benzene
CID 142968815
1-ethyl-4-[4-(trifluoromethoxy)phenyl]benzene
CID 19436313

Frequently Asked Questions

What is the IUPAC name of 1-methyl-5-[4-(trifluoromethoxy)phenyl]imidazole?
The IUPAC name of 1-methyl-5-[4-(trifluoromethoxy)phenyl]imidazole (CID 134354899) is 1-methyl-5-[4-(trifluoromethoxy)phenyl]imidazole.
What is the SMILES notation for 1-methyl-5-[4-(trifluoromethoxy)phenyl]imidazole?
The canonical SMILES for 1-methyl-5-[4-(trifluoromethoxy)phenyl]imidazole is Cn1cncc1-c1ccc(OC(F)(F)F)cc1.
What is the InChIKey of 1-methyl-5-[4-(trifluoromethoxy)phenyl]imidazole?
The InChIKey is QGVLFQLDCWEPIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9F3N2O/c1-16-7-15-6-10(16)8-2-4-9(5-3-8)17-11(12,13)14/h2-7H,1H3.
What are the key properties of 1-methyl-5-[4-(trifluoromethoxy)phenyl]imidazole?
1-methyl-5-[4-(trifluoromethoxy)phenyl]imidazole has a molecular weight of 242.20 g/mol, XLogP of 2.99, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-5-[4-(trifluoromethoxy)phenyl]imidazole is sourced from PubChem (CID 134354899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).