1-methyl-2-[4-(trifluoromethyl)phenyl]-4,5-dihydroimidazole

C11H11F3N2 — CID 110540583

IUPAC1-methyl-2-[4-(trifluoromethyl)phenyl]-4,5-dihydroimidazole
SMILESCN1CCN=C1c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C11H11F3N2/c1-16-7-6-15-10(16)8-2-4-9(5-3-8)11(12,13)14/h2-5H,6-7H2,1H3
InChIKeyFLMNJKQMAOFQHC-UHFFFAOYSA-N
MW228.22 g/mol
LogP2.40
Rot. Bonds1

About 1-methyl-2-[4-(trifluoromethyl)phenyl]-4,5-dihydroimidazole

1-methyl-2-[4-(trifluoromethyl)phenyl]-4,5-dihydroimidazole (PubChem CID 110540583) has the molecular formula C11H11F3N2 and a molecular weight of 228.22 g/mol. Its IUPAC name is 1-methyl-2-[4-(trifluoromethyl)phenyl]-4,5-dihydroimidazole.

Molecular Properties

Compound Name1-methyl-2-[4-(trifluoromethyl)phenyl]-4,5-dihydroimidazole
PubChem CID110540583
Molecular FormulaC11H11F3N2
Molecular Weight228.22 g/mol
Exact Mass228.09
IUPAC Name1-methyl-2-[4-(trifluoromethyl)phenyl]-4,5-dihydroimidazole
SMILESCN1CCN=C1c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C11H11F3N2/c1-16-7-6-15-10(16)8-2-4-9(5-3-8)11(12,13)14/h2-5H,6-7H2,1H3
InChIKeyFLMNJKQMAOFQHC-UHFFFAOYSA-N
XLogP2.40
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.22
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-[4-(1-methyl-4,5-dihydroimidazol-2-yl)phenyl]ethanone
CID 84670715
2-(4-ethoxyphenyl)-1-methyl-4,5-dihydroimidazole
CID 110540743
1-[(2-methoxyphenyl)methyl]-2-[4-(trifluoromethyl)phenyl]-4,5-dihydroimidazole
CID 146607964
1-methyl-N-[2-[4-(trifluoromethyl)phenyl]propyl]-4,5-dihydroimidazol-2-amine
CID 120972323
1-[4-(1-methyl-4,5-dihydroimidazol-2-yl)phenyl]cyclopentane-1-carboxylic acid
CID 117433813
3-[4-(1-methyl-4,5-dihydroimidazol-2-yl)phenyl]-1,2-oxazole-5-carboxylic acid
CID 117430746
[3-[4-(1-methyl-4,5-dihydroimidazol-2-yl)phenyl]-1,2,4-oxadiazol-5-yl]methanamine
CID 117396391
1-methyl-4-[4-[4-[4-(trifluoromethyl)phenyl]phenyl]phenyl]benzene
CID 59630308
N-[4-chloro-2-(dimethylamino)phenyl]-4-(1-methyl-4,5-dihydroimidazol-2-yl)benzamide
CID 70670824
11-[4-(trifluoromethyl)phenyl]-3,4,6,7-tetrahydro-2H-pyrimido[1,2-d][1,4]benzoxazepine
CID 71150292
(E)-but-2-enedioic acid;1-methyl-6-[4-(trifluoromethyl)phenyl]-3,4-dihydropyrrolo[1,2-a]pyrazine
CID 19095293
2-(3-ethoxyphenyl)-1-methyl-4,5-dihydroimidazole
CID 110540746

Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-[4-(trifluoromethyl)phenyl]-4,5-dihydroimidazole?
The IUPAC name of 1-methyl-2-[4-(trifluoromethyl)phenyl]-4,5-dihydroimidazole (CID 110540583) is 1-methyl-2-[4-(trifluoromethyl)phenyl]-4,5-dihydroimidazole.
What is the SMILES notation for 1-methyl-2-[4-(trifluoromethyl)phenyl]-4,5-dihydroimidazole?
The canonical SMILES for 1-methyl-2-[4-(trifluoromethyl)phenyl]-4,5-dihydroimidazole is CN1CCN=C1c1ccc(C(F)(F)F)cc1.
What is the InChIKey of 1-methyl-2-[4-(trifluoromethyl)phenyl]-4,5-dihydroimidazole?
The InChIKey is FLMNJKQMAOFQHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11F3N2/c1-16-7-6-15-10(16)8-2-4-9(5-3-8)11(12,13)14/h2-5H,6-7H2,1H3.
What are the key properties of 1-methyl-2-[4-(trifluoromethyl)phenyl]-4,5-dihydroimidazole?
1-methyl-2-[4-(trifluoromethyl)phenyl]-4,5-dihydroimidazole has a molecular weight of 228.22 g/mol, XLogP of 2.40, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-[4-(trifluoromethyl)phenyl]-4,5-dihydroimidazole is sourced from PubChem (CID 110540583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).