3-[5,5-bis(4-fluorophenyl)-1,4-dihydroimidazol-2-yl]-N,N-dimethylaniline

C23H21F2N3 — CID 44573566

IUPAC3-[5,5-bis(4-fluorophenyl)-1,4-dihydroimidazol-2-yl]-N,N-dimethylaniline
SMILESCN(C)c1cccc(C2=NCC(c3ccc(F)cc3)(c3ccc(F)cc3)N2)c1
InChIInChI=1S/C23H21F2N3/c1-28(2)21-5-3-4-16(14-21)22-26-15-23(27-22,17-6-10-19(24)11-7-17)18-8-12-20(25)13-9-18/h3-14H,15H2,1-2H3,(H,26,27)
InChIKeyAHIHRCLJRIXGEW-UHFFFAOYSA-N
MW377.44 g/mol
LogP4.32
Rot. Bonds4

About 3-[5,5-bis(4-fluorophenyl)-1,4-dihydroimidazol-2-yl]-N,N-dimethylaniline

3-[5,5-bis(4-fluorophenyl)-1,4-dihydroimidazol-2-yl]-N,N-dimethylaniline (PubChem CID 44573566) has the molecular formula C23H21F2N3 and a molecular weight of 377.44 g/mol. Its IUPAC name is 3-[5,5-bis(4-fluorophenyl)-1,4-dihydroimidazol-2-yl]-N,N-dimethylaniline.

Molecular Properties

Compound Name3-[5,5-bis(4-fluorophenyl)-1,4-dihydroimidazol-2-yl]-N,N-dimethylaniline
PubChem CID44573566
Molecular FormulaC23H21F2N3
Molecular Weight377.44 g/mol
Exact Mass377.17
IUPAC Name3-[5,5-bis(4-fluorophenyl)-1,4-dihydroimidazol-2-yl]-N,N-dimethylaniline
SMILESCN(C)c1cccc(C2=NCC(c3ccc(F)cc3)(c3ccc(F)cc3)N2)c1
InChIInChI=1S/C23H21F2N3/c1-28(2)21-5-3-4-16(14-21)22-26-15-23(27-22,17-6-10-19(24)11-7-17)18-8-12-20(25)13-9-18/h3-14H,15H2,1-2H3,(H,26,27)
InChIKeyAHIHRCLJRIXGEW-UHFFFAOYSA-N
XLogP4.32
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.44
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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4,4-bis(4-fluorophenyl)-2-m-tolyl-4,5-dihydro-1H-imidazole
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4,4-bis(4-fluorophenyl)-2-(3-nitrophenyl)-4,5-dihydro-1H-imidazole
CID 10293081
(N1,N1'Z,N1,N1'Z)-N1,N1'-(isoindoline-1,3-diylidene)bis(N4,N4-dimethylbenzene-1,4-diamine)
CID 1878836
N-[1-(4,5-dihydro-1H-imidazol-2-yl)ethyl]-2-phenylaniline
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4,4-bis(4-fluorophenyl)-2-phenyl-4,5-dihydro-1H-imidazole
CID 44573407
3-(4,4-bis(4-fluorophenyl)-4,5-dihydro-1H-imidazol-2-yl)aniline
CID 44573565
1,4-Benzenedicarboximidamide, N'1,N'4-bis[3-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-N1,N4-diethyl-
CID 251927
[5-(2-Fluoro-phenyl)-1-methyl-2,3-dihydro-1H-benzo[e][1,4]diazepin-2-ylmethyl]-(3-trifluoromethyl-phenyl)-amine
CID 19766234
Benzenecarboximidamide, N-cyclohexyl-N'-(4-fluorophenyl)-, monohydrochloride
CID 3043196

Frequently Asked Questions

What is the IUPAC name of 3-[5,5-bis(4-fluorophenyl)-1,4-dihydroimidazol-2-yl]-N,N-dimethylaniline?
The IUPAC name of 3-[5,5-bis(4-fluorophenyl)-1,4-dihydroimidazol-2-yl]-N,N-dimethylaniline (CID 44573566) is 3-[5,5-bis(4-fluorophenyl)-1,4-dihydroimidazol-2-yl]-N,N-dimethylaniline.
What is the SMILES notation for 3-[5,5-bis(4-fluorophenyl)-1,4-dihydroimidazol-2-yl]-N,N-dimethylaniline?
The canonical SMILES for 3-[5,5-bis(4-fluorophenyl)-1,4-dihydroimidazol-2-yl]-N,N-dimethylaniline is CN(C)c1cccc(C2=NCC(c3ccc(F)cc3)(c3ccc(F)cc3)N2)c1.
What is the InChIKey of 3-[5,5-bis(4-fluorophenyl)-1,4-dihydroimidazol-2-yl]-N,N-dimethylaniline?
The InChIKey is AHIHRCLJRIXGEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21F2N3/c1-28(2)21-5-3-4-16(14-21)22-26-15-23(27-22,17-6-10-19(24)11-7-17)18-8-12-20(25)13-9-18/h3-14H,15H2,1-2H3,(H,26,27).
What are the key properties of 3-[5,5-bis(4-fluorophenyl)-1,4-dihydroimidazol-2-yl]-N,N-dimethylaniline?
3-[5,5-bis(4-fluorophenyl)-1,4-dihydroimidazol-2-yl]-N,N-dimethylaniline has a molecular weight of 377.44 g/mol, XLogP of 4.32, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[5,5-bis(4-fluorophenyl)-1,4-dihydroimidazol-2-yl]-N,N-dimethylaniline is sourced from PubChem (CID 44573566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).