phenyl-[2-phenyl-5-(trifluoromethyl)-2,4-dihydroimidazol-3-yl]methanone

C17H13F3N2O — CID 15325215

IUPACphenyl-[2-phenyl-5-(trifluoromethyl)-2,4-dihydroimidazol-3-yl]methanone
SMILESO=C(c1ccccc1)N1CC(C(F)(F)F)=NC1c1ccccc1
InChIInChI=1S/C17H13F3N2O/c18-17(19,20)14-11-22(16(23)13-9-5-2-6-10-13)15(21-14)12-7-3-1-4-8-12/h1-10,15H,11H2
InChIKeyHVOPSKKVCIKXGF-UHFFFAOYSA-N
MW318.30 g/mol
LogP3.84
Rot. Bonds2

About phenyl-[2-phenyl-5-(trifluoromethyl)-2,4-dihydroimidazol-3-yl]methanone

phenyl-[2-phenyl-5-(trifluoromethyl)-2,4-dihydroimidazol-3-yl]methanone (PubChem CID 15325215) has the molecular formula C17H13F3N2O and a molecular weight of 318.30 g/mol. Its IUPAC name is phenyl-[2-phenyl-5-(trifluoromethyl)-2,4-dihydroimidazol-3-yl]methanone.

Molecular Properties

Compound Namephenyl-[2-phenyl-5-(trifluoromethyl)-2,4-dihydroimidazol-3-yl]methanone
PubChem CID15325215
Molecular FormulaC17H13F3N2O
Molecular Weight318.30 g/mol
Exact Mass318.10
IUPAC Namephenyl-[2-phenyl-5-(trifluoromethyl)-2,4-dihydroimidazol-3-yl]methanone
SMILESO=C(c1ccccc1)N1CC(C(F)(F)F)=NC1c1ccccc1
InChIInChI=1S/C17H13F3N2O/c18-17(19,20)14-11-22(16(23)13-9-5-2-6-10-13)15(21-14)12-7-3-1-4-8-12/h1-10,15H,11H2
InChIKeyHVOPSKKVCIKXGF-UHFFFAOYSA-N
XLogP3.84
TPSA32.67 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.30
LogP ≤ 53.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of phenyl-[2-phenyl-5-(trifluoromethyl)-2,4-dihydroimidazol-3-yl]methanone?
The IUPAC name of phenyl-[2-phenyl-5-(trifluoromethyl)-2,4-dihydroimidazol-3-yl]methanone (CID 15325215) is phenyl-[2-phenyl-5-(trifluoromethyl)-2,4-dihydroimidazol-3-yl]methanone.
What is the SMILES notation for phenyl-[2-phenyl-5-(trifluoromethyl)-2,4-dihydroimidazol-3-yl]methanone?
The canonical SMILES for phenyl-[2-phenyl-5-(trifluoromethyl)-2,4-dihydroimidazol-3-yl]methanone is O=C(c1ccccc1)N1CC(C(F)(F)F)=NC1c1ccccc1.
What is the InChIKey of phenyl-[2-phenyl-5-(trifluoromethyl)-2,4-dihydroimidazol-3-yl]methanone?
The InChIKey is HVOPSKKVCIKXGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13F3N2O/c18-17(19,20)14-11-22(16(23)13-9-5-2-6-10-13)15(21-14)12-7-3-1-4-8-12/h1-10,15H,11H2.
What are the key properties of phenyl-[2-phenyl-5-(trifluoromethyl)-2,4-dihydroimidazol-3-yl]methanone?
phenyl-[2-phenyl-5-(trifluoromethyl)-2,4-dihydroimidazol-3-yl]methanone has a molecular weight of 318.30 g/mol, XLogP of 3.84, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl-[2-phenyl-5-(trifluoromethyl)-2,4-dihydroimidazol-3-yl]methanone is sourced from PubChem (CID 15325215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).