2-methyl-4-(trifluoromethyl)-1-[[1-(trifluoromethyl)cyclopropyl]methyl]imidazole

C10H10F6N2 — CID 177142089

IUPAC2-methyl-4-(trifluoromethyl)-1-[[1-(trifluoromethyl)cyclopropyl]methyl]imidazole
SMILESCc1nc(C(F)(F)F)cn1CC1(C(F)(F)F)CC1
InChIInChI=1S/C10H10F6N2/c1-6-17-7(9(11,12)13)4-18(6)5-8(2-3-8)10(14,15)16/h4H,2-3,5H2,1H3
InChIKeyNWZPQXBPOSBFNQ-UHFFFAOYSA-N
MW272.19 g/mol
LogP3.55
Rot. Bonds2

About 2-methyl-4-(trifluoromethyl)-1-[[1-(trifluoromethyl)cyclopropyl]methyl]imidazole

2-methyl-4-(trifluoromethyl)-1-[[1-(trifluoromethyl)cyclopropyl]methyl]imidazole (PubChem CID 177142089) has the molecular formula C10H10F6N2 and a molecular weight of 272.19 g/mol. Its IUPAC name is 2-methyl-4-(trifluoromethyl)-1-[[1-(trifluoromethyl)cyclopropyl]methyl]imidazole.

Molecular Properties

Compound Name2-methyl-4-(trifluoromethyl)-1-[[1-(trifluoromethyl)cyclopropyl]methyl]imidazole
PubChem CID177142089
Molecular FormulaC10H10F6N2
Molecular Weight272.19 g/mol
Exact Mass272.07
IUPAC Name2-methyl-4-(trifluoromethyl)-1-[[1-(trifluoromethyl)cyclopropyl]methyl]imidazole
SMILESCc1nc(C(F)(F)F)cn1CC1(C(F)(F)F)CC1
InChIInChI=1S/C10H10F6N2/c1-6-17-7(9(11,12)13)4-18(6)5-8(2-3-8)10(14,15)16/h4H,2-3,5H2,1H3
InChIKeyNWZPQXBPOSBFNQ-UHFFFAOYSA-N
XLogP3.55
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.19
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-methyl-4-(trifluoromethyl)-1-[[1-(trifluoromethyl)cyclopropyl]methyl]imidazole with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-(trifluoromethyl)-1-[[1-(trifluoromethyl)cyclopropyl]methyl]imidazole?
The IUPAC name of 2-methyl-4-(trifluoromethyl)-1-[[1-(trifluoromethyl)cyclopropyl]methyl]imidazole (CID 177142089) is 2-methyl-4-(trifluoromethyl)-1-[[1-(trifluoromethyl)cyclopropyl]methyl]imidazole.
What is the SMILES notation for 2-methyl-4-(trifluoromethyl)-1-[[1-(trifluoromethyl)cyclopropyl]methyl]imidazole?
The canonical SMILES for 2-methyl-4-(trifluoromethyl)-1-[[1-(trifluoromethyl)cyclopropyl]methyl]imidazole is Cc1nc(C(F)(F)F)cn1CC1(C(F)(F)F)CC1.
What is the InChIKey of 2-methyl-4-(trifluoromethyl)-1-[[1-(trifluoromethyl)cyclopropyl]methyl]imidazole?
The InChIKey is NWZPQXBPOSBFNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F6N2/c1-6-17-7(9(11,12)13)4-18(6)5-8(2-3-8)10(14,15)16/h4H,2-3,5H2,1H3.
What are the key properties of 2-methyl-4-(trifluoromethyl)-1-[[1-(trifluoromethyl)cyclopropyl]methyl]imidazole?
2-methyl-4-(trifluoromethyl)-1-[[1-(trifluoromethyl)cyclopropyl]methyl]imidazole has a molecular weight of 272.19 g/mol, XLogP of 3.55, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-(trifluoromethyl)-1-[[1-(trifluoromethyl)cyclopropyl]methyl]imidazole is sourced from PubChem (CID 177142089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).