2-[4-(trifluoromethyl)phenyl]-4,5-dihydro-1H-imidazole

C10H9F3N2 — CID 11241345

IUPAC2-[4-(trifluoromethyl)phenyl]-4,5-dihydro-1H-imidazole
SMILESFC(F)(F)c1ccc(C2=NCCN2)cc1
InChIInChI=1S/C10H9F3N2/c11-10(12,13)8-3-1-7(2-4-8)9-14-5-6-15-9/h1-4H,5-6H2,(H,14,15)
InChIKeyXYDNTALWFYHWQB-UHFFFAOYSA-N
MW214.19 g/mol
LogP2.06
Rot. Bonds1

About 2-[4-(trifluoromethyl)phenyl]-4,5-dihydro-1H-imidazole

2-[4-(trifluoromethyl)phenyl]-4,5-dihydro-1H-imidazole (PubChem CID 11241345) has the molecular formula C10H9F3N2 and a molecular weight of 214.19 g/mol. Its IUPAC name is 2-[4-(trifluoromethyl)phenyl]-4,5-dihydro-1H-imidazole.

Molecular Properties

Compound Name2-[4-(trifluoromethyl)phenyl]-4,5-dihydro-1H-imidazole
PubChem CID11241345
Molecular FormulaC10H9F3N2
Molecular Weight214.19 g/mol
Exact Mass214.07
IUPAC Name2-[4-(trifluoromethyl)phenyl]-4,5-dihydro-1H-imidazole
SMILESFC(F)(F)c1ccc(C2=NCCN2)cc1
InChIInChI=1S/C10H9F3N2/c11-10(12,13)8-3-1-7(2-4-8)9-14-5-6-15-9/h1-4H,5-6H2,(H,14,15)
InChIKeyXYDNTALWFYHWQB-UHFFFAOYSA-N
XLogP2.06
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.19
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(trifluoromethyl)phenyl]-4,5-dihydro-1H-imidazole?
The IUPAC name of 2-[4-(trifluoromethyl)phenyl]-4,5-dihydro-1H-imidazole (CID 11241345) is 2-[4-(trifluoromethyl)phenyl]-4,5-dihydro-1H-imidazole.
What is the SMILES notation for 2-[4-(trifluoromethyl)phenyl]-4,5-dihydro-1H-imidazole?
The canonical SMILES for 2-[4-(trifluoromethyl)phenyl]-4,5-dihydro-1H-imidazole is FC(F)(F)c1ccc(C2=NCCN2)cc1.
What is the InChIKey of 2-[4-(trifluoromethyl)phenyl]-4,5-dihydro-1H-imidazole?
The InChIKey is XYDNTALWFYHWQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9F3N2/c11-10(12,13)8-3-1-7(2-4-8)9-14-5-6-15-9/h1-4H,5-6H2,(H,14,15).
What are the key properties of 2-[4-(trifluoromethyl)phenyl]-4,5-dihydro-1H-imidazole?
2-[4-(trifluoromethyl)phenyl]-4,5-dihydro-1H-imidazole has a molecular weight of 214.19 g/mol, XLogP of 2.06, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(trifluoromethyl)phenyl]-4,5-dihydro-1H-imidazole is sourced from PubChem (CID 11241345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).