1-(2-fluorophenyl)-4-(trifluoromethyl)imidazole

C10H6F4N2 — CID 154447473

IUPAC1-(2-fluorophenyl)-4-(trifluoromethyl)imidazole
SMILESFc1ccccc1-n1cnc(C(F)(F)F)c1
InChIInChI=1S/C10H6F4N2/c11-7-3-1-2-4-8(7)16-5-9(15-6-16)10(12,13)14/h1-6H
InChIKeySVYATLYZUULBBE-UHFFFAOYSA-N
MW230.16 g/mol
LogP3.03
Rot. Bonds1

About 1-(2-fluorophenyl)-4-(trifluoromethyl)imidazole

1-(2-fluorophenyl)-4-(trifluoromethyl)imidazole (PubChem CID 154447473) has the molecular formula C10H6F4N2 and a molecular weight of 230.16 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-4-(trifluoromethyl)imidazole.

Molecular Properties

Compound Name1-(2-fluorophenyl)-4-(trifluoromethyl)imidazole
PubChem CID154447473
Molecular FormulaC10H6F4N2
Molecular Weight230.16 g/mol
Exact Mass230.05
IUPAC Name1-(2-fluorophenyl)-4-(trifluoromethyl)imidazole
SMILESFc1ccccc1-n1cnc(C(F)(F)F)c1
InChIInChI=1S/C10H6F4N2/c11-7-3-1-2-4-8(7)16-5-9(15-6-16)10(12,13)14/h1-6H
InChIKeySVYATLYZUULBBE-UHFFFAOYSA-N
XLogP3.03
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.16
LogP ≤ 53.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Trim
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1-Phenylimidazole
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1-(4-Chlorophenyl)-1H-imidazole
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4-(2-methyl-1H-imidazol-1-yl)aniline
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4-(1H-imidazol-1-yl)aniline
CID 320165
1-(3-Chlorophenyl)-1H-imidazole
CID 99349
1-(4-Fluorophenyl)imidazole
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Imidazo(1,5-a)pyridine
CID 274090
N-(1H-imidazol-4-ylmethyl)aniline
CID 13178307
3-(2-Methyl-1H-imidazol-1-yl)pyridine
CID 16654686
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CID 46222042

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-4-(trifluoromethyl)imidazole?
The IUPAC name of 1-(2-fluorophenyl)-4-(trifluoromethyl)imidazole (CID 154447473) is 1-(2-fluorophenyl)-4-(trifluoromethyl)imidazole.
What is the SMILES notation for 1-(2-fluorophenyl)-4-(trifluoromethyl)imidazole?
The canonical SMILES for 1-(2-fluorophenyl)-4-(trifluoromethyl)imidazole is Fc1ccccc1-n1cnc(C(F)(F)F)c1.
What is the InChIKey of 1-(2-fluorophenyl)-4-(trifluoromethyl)imidazole?
The InChIKey is SVYATLYZUULBBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6F4N2/c11-7-3-1-2-4-8(7)16-5-9(15-6-16)10(12,13)14/h1-6H.
What are the key properties of 1-(2-fluorophenyl)-4-(trifluoromethyl)imidazole?
1-(2-fluorophenyl)-4-(trifluoromethyl)imidazole has a molecular weight of 230.16 g/mol, XLogP of 3.03, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-4-(trifluoromethyl)imidazole is sourced from PubChem (CID 154447473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).