5,5-bis[(4-fluorophenyl)methyl]-2-methyl-1,4-dihydroimidazole

C18H18F2N2 — CID 66713622

IUPAC5,5-bis[(4-fluorophenyl)methyl]-2-methyl-1,4-dihydroimidazole
SMILESCC1=NCC(Cc2ccc(F)cc2)(Cc2ccc(F)cc2)N1
InChIInChI=1S/C18H18F2N2/c1-13-21-12-18(22-13,10-14-2-6-16(19)7-3-14)11-15-4-8-17(20)9-5-15/h2-9H,10-12H2,1H3,(H,21,22)
InChIKeyGFHORYQKEYZSSN-UHFFFAOYSA-N
MW300.35 g/mol
LogP3.51
Rot. Bonds4

About 5,5-bis[(4-fluorophenyl)methyl]-2-methyl-1,4-dihydroimidazole

5,5-bis[(4-fluorophenyl)methyl]-2-methyl-1,4-dihydroimidazole (PubChem CID 66713622) has the molecular formula C18H18F2N2 and a molecular weight of 300.35 g/mol. Its IUPAC name is 5,5-bis[(4-fluorophenyl)methyl]-2-methyl-1,4-dihydroimidazole.

Molecular Properties

Compound Name5,5-bis[(4-fluorophenyl)methyl]-2-methyl-1,4-dihydroimidazole
PubChem CID66713622
Molecular FormulaC18H18F2N2
Molecular Weight300.35 g/mol
Exact Mass300.14
IUPAC Name5,5-bis[(4-fluorophenyl)methyl]-2-methyl-1,4-dihydroimidazole
SMILESCC1=NCC(Cc2ccc(F)cc2)(Cc2ccc(F)cc2)N1
InChIInChI=1S/C18H18F2N2/c1-13-21-12-18(22-13,10-14-2-6-16(19)7-3-14)11-15-4-8-17(20)9-5-15/h2-9H,10-12H2,1H3,(H,21,22)
InChIKeyGFHORYQKEYZSSN-UHFFFAOYSA-N
XLogP3.51
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.35
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-Biphenyl-2-yl-ethyl)-4,5-dihydro-1H-imidazole
CID 23242865
2-(3-fluorophenyl)-4,4-bis(4-fluorophenyl)-4,5-dihydro-1H-imidazole
CID 9924627
4,4-bis(4-fluorophenyl)-2-m-tolyl-4,5-dihydro-1H-imidazole
CID 10154767
(4R,5S)-2-[(2-fluorophenyl)methyl]-4,5-diphenyl-4,5-dihydro-1H-imidazole
CID 11209712
(4R,5S)-2-[2-(2-fluorophenyl)ethyl]-4,5-diphenyl-4,5-dihydro-1H-imidazole
CID 11416652
(4R,5S)-2-[(2,3-difluorophenyl)methyl]-4,5-diphenyl-4,5-dihydro-1H-imidazole
CID 11462177
(4R,5S)-2-[2-(3-fluorophenyl)ethyl]-4,5-diphenyl-4,5-dihydro-1H-imidazole
CID 44388772
(4R,5S)-2-[2-(4-fluorophenyl)ethyl]-4,5-diphenyl-4,5-dihydro-1H-imidazole
CID 44388773
(4R,5S)-2-[(3-fluorophenyl)methyl]-4,5-diphenyl-4,5-dihydro-1H-imidazole
CID 44388973
(4R,5S)-2-[(4-fluorophenyl)methyl]-4,5-diphenyl-4,5-dihydro-1H-imidazole
CID 44388975
(4R,5S)-2-[2-(3,4-difluorophenyl)ethyl]-4,5-diphenyl-4,5-dihydro-1H-imidazole
CID 44388990
(4R,5S)-2-[(3,4-difluorophenyl)methyl]-4,5-diphenyl-4,5-dihydro-1H-imidazole
CID 44388991

Frequently Asked Questions

What is the IUPAC name of 5,5-bis[(4-fluorophenyl)methyl]-2-methyl-1,4-dihydroimidazole?
The IUPAC name of 5,5-bis[(4-fluorophenyl)methyl]-2-methyl-1,4-dihydroimidazole (CID 66713622) is 5,5-bis[(4-fluorophenyl)methyl]-2-methyl-1,4-dihydroimidazole.
What is the SMILES notation for 5,5-bis[(4-fluorophenyl)methyl]-2-methyl-1,4-dihydroimidazole?
The canonical SMILES for 5,5-bis[(4-fluorophenyl)methyl]-2-methyl-1,4-dihydroimidazole is CC1=NCC(Cc2ccc(F)cc2)(Cc2ccc(F)cc2)N1.
What is the InChIKey of 5,5-bis[(4-fluorophenyl)methyl]-2-methyl-1,4-dihydroimidazole?
The InChIKey is GFHORYQKEYZSSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18F2N2/c1-13-21-12-18(22-13,10-14-2-6-16(19)7-3-14)11-15-4-8-17(20)9-5-15/h2-9H,10-12H2,1H3,(H,21,22).
What are the key properties of 5,5-bis[(4-fluorophenyl)methyl]-2-methyl-1,4-dihydroimidazole?
5,5-bis[(4-fluorophenyl)methyl]-2-methyl-1,4-dihydroimidazole has a molecular weight of 300.35 g/mol, XLogP of 3.51, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-bis[(4-fluorophenyl)methyl]-2-methyl-1,4-dihydroimidazole is sourced from PubChem (CID 66713622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).