(4-ethylphenyl)-[5-(2-fluorophenyl)-1H-imidazol-2-yl]methanol

C18H17FN2O — CID 46948492

IUPAC(4-ethylphenyl)-[5-(2-fluorophenyl)-1H-imidazol-2-yl]methanol
SMILESCCc1ccc(C(O)c2ncc(-c3ccccc3F)[nH]2)cc1
InChIInChI=1S/C18H17FN2O/c1-2-12-7-9-13(10-8-12)17(22)18-20-11-16(21-18)14-5-3-4-6-15(14)19/h3-11,17,22H,2H2,1H3,(H,20,21)
InChIKeyXQHURDNPTHCVBS-UHFFFAOYSA-N
MW296.34 g/mol
LogP3.86
Rot. Bonds4

About (4-ethylphenyl)-[5-(2-fluorophenyl)-1H-imidazol-2-yl]methanol

(4-ethylphenyl)-[5-(2-fluorophenyl)-1H-imidazol-2-yl]methanol (PubChem CID 46948492) has the molecular formula C18H17FN2O and a molecular weight of 296.34 g/mol. Its IUPAC name is (4-ethylphenyl)-[5-(2-fluorophenyl)-1H-imidazol-2-yl]methanol.

Molecular Properties

Compound Name(4-ethylphenyl)-[5-(2-fluorophenyl)-1H-imidazol-2-yl]methanol
PubChem CID46948492
Molecular FormulaC18H17FN2O
Molecular Weight296.34 g/mol
Exact Mass296.13
IUPAC Name(4-ethylphenyl)-[5-(2-fluorophenyl)-1H-imidazol-2-yl]methanol
SMILESCCc1ccc(C(O)c2ncc(-c3ccccc3F)[nH]2)cc1
InChIInChI=1S/C18H17FN2O/c1-2-12-7-9-13(10-8-12)17(22)18-20-11-16(21-18)14-5-3-4-6-15(14)19/h3-11,17,22H,2H2,1H3,(H,20,21)
InChIKeyXQHURDNPTHCVBS-UHFFFAOYSA-N
XLogP3.86
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.34
LogP ≤ 53.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-[3-(4-fluorophenyl)phenyl]-1-(1H-imidazol-5-yl)-2-methylpropan-1-ol
CID 9883170
1-(4'-fluoro[1,1'-biphenyl]-4-yl)-1-(1H-imidazol-4-yl)-2-methyl-1-propanol
CID 9883171
rac-1-[1,1''-biphenyl]-3-yl-1-(1H-imidazol-4-yl)-2-methyl-1-propanol
CID 9904146
rac-1-[1,1''-Biphenyl]-4-yl-1-(1H-imidazol-4-yl)-2-methyl-1-propanol
CID 12043372
1-[3-(4-fluorophenyl)-3-hydroxy-3-pyridin-2-ylpropyl]-2-[3-(1H-imidazol-5-yl)propyl]guanidine
CID 14660410
2-((1-hydroxy)cyclohexyl)-4-(4-fluorophenyl)-5-(4-pyridyl)-1H-imidazole
CID 18367514
N-[4'-[1-hydroxy-1-(1H-imidazol-4yl)propyl][1,1'-biphenyl]-3-yl]acetamide
CID 18668538
N-(6-{4-[1-hydroxy-1-(1H-imidazol-4-yl)-2-methylpropyl]phenyl}-2-pyridyl)acetamide
CID 18668580
N-{4'-[1-hydroxy-1-(1H-imidazol-4-yl)-2-methylpropyl][1,1'-biphenyl]-4-yl}acetamide
CID 18668583
N-{4'-[1-hydroxy-1-(1H-imidazol-4-yl)-2-methylpropyl][1,1'-biphenyl]-3-yl}acetamide
CID 18668593
N-[4'-[cyclopropyl(hydroxy) (1H-imidazol-4-yl)methyl][1,1'-biphenyl]-3-yl]acetamide
CID 18668607
N-[3-[4-[1-hydroxy-1-(1H-imidazol-5-yl)ethyl]phenyl]phenyl]acetamide
CID 18668617

Frequently Asked Questions

What is the IUPAC name of (4-ethylphenyl)-[5-(2-fluorophenyl)-1H-imidazol-2-yl]methanol?
The IUPAC name of (4-ethylphenyl)-[5-(2-fluorophenyl)-1H-imidazol-2-yl]methanol (CID 46948492) is (4-ethylphenyl)-[5-(2-fluorophenyl)-1H-imidazol-2-yl]methanol.
What is the SMILES notation for (4-ethylphenyl)-[5-(2-fluorophenyl)-1H-imidazol-2-yl]methanol?
The canonical SMILES for (4-ethylphenyl)-[5-(2-fluorophenyl)-1H-imidazol-2-yl]methanol is CCc1ccc(C(O)c2ncc(-c3ccccc3F)[nH]2)cc1.
What is the InChIKey of (4-ethylphenyl)-[5-(2-fluorophenyl)-1H-imidazol-2-yl]methanol?
The InChIKey is XQHURDNPTHCVBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17FN2O/c1-2-12-7-9-13(10-8-12)17(22)18-20-11-16(21-18)14-5-3-4-6-15(14)19/h3-11,17,22H,2H2,1H3,(H,20,21).
What are the key properties of (4-ethylphenyl)-[5-(2-fluorophenyl)-1H-imidazol-2-yl]methanol?
(4-ethylphenyl)-[5-(2-fluorophenyl)-1H-imidazol-2-yl]methanol has a molecular weight of 296.34 g/mol, XLogP of 3.86, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethylphenyl)-[5-(2-fluorophenyl)-1H-imidazol-2-yl]methanol is sourced from PubChem (CID 46948492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).