1-(4-fluorophenyl)-2-imidazol-1-yl-1-(4-pyridin-4-ylphenyl)ethanol

C22H18FN3O — CID 10361089

IUPAC1-(4-fluorophenyl)-2-imidazol-1-yl-1-(4-pyridin-4-ylphenyl)ethanol
SMILESOC(Cn1ccnc1)(c1ccc(F)cc1)c1ccc(-c2ccncc2)cc1
InChIInChI=1S/C22H18FN3O/c23-21-7-5-20(6-8-21)22(27,15-26-14-13-25-16-26)19-3-1-17(2-4-19)18-9-11-24-12-10-18/h1-14,16,27H,15H2
InChIKeyDZGMNXWTQWGZTK-UHFFFAOYSA-N
MW359.40 g/mol
LogP4.02
Rot. Bonds5

About 1-(4-fluorophenyl)-2-imidazol-1-yl-1-(4-pyridin-4-ylphenyl)ethanol

1-(4-fluorophenyl)-2-imidazol-1-yl-1-(4-pyridin-4-ylphenyl)ethanol (PubChem CID 10361089) has the molecular formula C22H18FN3O and a molecular weight of 359.40 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-2-imidazol-1-yl-1-(4-pyridin-4-ylphenyl)ethanol.

Molecular Properties

Compound Name1-(4-fluorophenyl)-2-imidazol-1-yl-1-(4-pyridin-4-ylphenyl)ethanol
PubChem CID10361089
Molecular FormulaC22H18FN3O
Molecular Weight359.40 g/mol
Exact Mass359.14
IUPAC Name1-(4-fluorophenyl)-2-imidazol-1-yl-1-(4-pyridin-4-ylphenyl)ethanol
SMILESOC(Cn1ccnc1)(c1ccc(F)cc1)c1ccc(-c2ccncc2)cc1
InChIInChI=1S/C22H18FN3O/c23-21-7-5-20(6-8-21)22(27,15-26-14-13-25-16-26)19-3-1-17(2-4-19)18-9-11-24-12-10-18/h1-14,16,27H,15H2
InChIKeyDZGMNXWTQWGZTK-UHFFFAOYSA-N
XLogP4.02
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.40
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-(4-Fluoro-3-(pyridin-3-yl)phenyl)imidazo[1,2-a]pyrimidin-7-yl)propan-2-ol
CID 9906309
2-(3-(4-Fluoro-3-(pyridin-4-yl)phenyl)imidazo[1,2-a]pyrimidin-7-yl)propan-2-ol
CID 10269219
4-[1-Hydroxy-1-(3-methyl-3H-imidazol-4-yl)-3-(6-methyl-pyridin-3-yl)-prop-2-ynyl]-2-naphthalen-1-yl-benzonitrile
CID 44459321
1-[3-(4-fluorophenyl)-3-hydroxy-3-pyridin-2-ylpropyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine
CID 14660410
1-[4-(2,2-Dimethylpropyl)-1h-imidazol-2-yl]-2-[4-(5-fluoropyridin-2-yl)phenyl]propan-2-ol
CID 25026445
(S)-1-((5aR,6S)-1-(4-Fluorophenyl)-5a-methyl-5,5a,6,7,8,9-hexahydroimidazo[1,5-b]isoquinolin-6-yl)-1-(pyridin-2-yl)ethanol
CID 45486465
(S)-1-((5aR,6S)-1-(4-Fluorophenyl)-5a-methyl-5,5a,6,7,8,9-hexahydroimidazo[1,5-b]isoquinolin-6-yl)-1-(pyridin-3-yl)ethanol
CID 45486477
(S)-1-((5aR,6S)-1-(4-Fluorophenyl)-5a-methyl-5,5a,6,7,8,9-hexahydroimidazo[1,5-b]isoquinolin-6-yl)-1-(pyridin-4-yl)ethanol
CID 45486485
rac-1-(1H-Imidazol-4-yl)-2-methyl-1-[4-(2-pyridinyl)phenyl]-1-propanol
CID 54582428
1-(3-Benzyl-2-methylimidazol-4-yl)-1-(2-methylphenyl)ethanol
CID 304292
(4-methylphenyl)(1-methyl-2-propyl-1H-imidazol-5-yl)phenylmethanol
CID 3932949
(2R,3S)-2-(2,4-difluorophenyl)-3-(5-fluoropyrimidin-4-yl)-1-imidazol-1-ylbutan-2-ol
CID 25132724

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-2-imidazol-1-yl-1-(4-pyridin-4-ylphenyl)ethanol?
The IUPAC name of 1-(4-fluorophenyl)-2-imidazol-1-yl-1-(4-pyridin-4-ylphenyl)ethanol (CID 10361089) is 1-(4-fluorophenyl)-2-imidazol-1-yl-1-(4-pyridin-4-ylphenyl)ethanol.
What is the SMILES notation for 1-(4-fluorophenyl)-2-imidazol-1-yl-1-(4-pyridin-4-ylphenyl)ethanol?
The canonical SMILES for 1-(4-fluorophenyl)-2-imidazol-1-yl-1-(4-pyridin-4-ylphenyl)ethanol is OC(Cn1ccnc1)(c1ccc(F)cc1)c1ccc(-c2ccncc2)cc1.
What is the InChIKey of 1-(4-fluorophenyl)-2-imidazol-1-yl-1-(4-pyridin-4-ylphenyl)ethanol?
The InChIKey is DZGMNXWTQWGZTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18FN3O/c23-21-7-5-20(6-8-21)22(27,15-26-14-13-25-16-26)19-3-1-17(2-4-19)18-9-11-24-12-10-18/h1-14,16,27H,15H2.
What are the key properties of 1-(4-fluorophenyl)-2-imidazol-1-yl-1-(4-pyridin-4-ylphenyl)ethanol?
1-(4-fluorophenyl)-2-imidazol-1-yl-1-(4-pyridin-4-ylphenyl)ethanol has a molecular weight of 359.40 g/mol, XLogP of 4.02, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-2-imidazol-1-yl-1-(4-pyridin-4-ylphenyl)ethanol is sourced from PubChem (CID 10361089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).