2-(4-fluoro-2-methylphenyl)-1-(1H-imidazol-2-yl)ethanol

C12H13FN2O — CID 114347532

IUPAC2-(4-fluoro-2-methylphenyl)-1-(1H-imidazol-2-yl)ethanol
SMILESCc1cc(F)ccc1CC(O)c1ncc[nH]1
InChIInChI=1S/C12H13FN2O/c1-8-6-10(13)3-2-9(8)7-11(16)12-14-4-5-15-12/h2-6,11,16H,7H2,1H3,(H,14,15)
InChIKeyLDKDGVZFVISQRZ-UHFFFAOYSA-N
MW220.25 g/mol
LogP2.13
Rot. Bonds3

About 2-(4-fluoro-2-methylphenyl)-1-(1H-imidazol-2-yl)ethanol

2-(4-fluoro-2-methylphenyl)-1-(1H-imidazol-2-yl)ethanol (PubChem CID 114347532) has the molecular formula C12H13FN2O and a molecular weight of 220.25 g/mol. Its IUPAC name is 2-(4-fluoro-2-methylphenyl)-1-(1H-imidazol-2-yl)ethanol.

Molecular Properties

Compound Name2-(4-fluoro-2-methylphenyl)-1-(1H-imidazol-2-yl)ethanol
PubChem CID114347532
Molecular FormulaC12H13FN2O
Molecular Weight220.25 g/mol
Exact Mass220.10
IUPAC Name2-(4-fluoro-2-methylphenyl)-1-(1H-imidazol-2-yl)ethanol
SMILESCc1cc(F)ccc1CC(O)c1ncc[nH]1
InChIInChI=1S/C12H13FN2O/c1-8-6-10(13)3-2-9(8)7-11(16)12-14-4-5-15-12/h2-6,11,16H,7H2,1H3,(H,14,15)
InChIKeyLDKDGVZFVISQRZ-UHFFFAOYSA-N
XLogP2.13
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.25
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-fluoro-2-methylphenyl)propan-2-ol
CID 91636360
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3-(4-fluoro-2-methylphenyl)-2-(4-fluorophenyl)propan-1-ol
CID 114349840
1-(3-ethyl-1-methylpyrazol-5-yl)-2-(4-fluoro-2-methylphenyl)ethanol
CID 105131290
1-(4-ethoxyphenyl)-2-(4-fluoro-2-methylphenyl)ethanol
CID 114346759
1-(1H-imidazol-2-yl)propan-1-ol;hydrochloride
CID 55254704
2-amino-3-(4-fluoro-2-methylphenyl)propan-1-ol
CID 115649532
2-(4-fluoro-2-methylphenyl)-1-(3-propylimidazol-4-yl)ethanol
CID 114346924
2-(2,4-difluorophenyl)-1-(4-fluoro-2,6-dimethylphenyl)ethanol
CID 106879490
2-[(4-fluoro-2-methylphenyl)methyl]-4-methylpentan-1-ol
CID 114349814
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CID 106266549

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluoro-2-methylphenyl)-1-(1H-imidazol-2-yl)ethanol?
The IUPAC name of 2-(4-fluoro-2-methylphenyl)-1-(1H-imidazol-2-yl)ethanol (CID 114347532) is 2-(4-fluoro-2-methylphenyl)-1-(1H-imidazol-2-yl)ethanol.
What is the SMILES notation for 2-(4-fluoro-2-methylphenyl)-1-(1H-imidazol-2-yl)ethanol?
The canonical SMILES for 2-(4-fluoro-2-methylphenyl)-1-(1H-imidazol-2-yl)ethanol is Cc1cc(F)ccc1CC(O)c1ncc[nH]1.
What is the InChIKey of 2-(4-fluoro-2-methylphenyl)-1-(1H-imidazol-2-yl)ethanol?
The InChIKey is LDKDGVZFVISQRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13FN2O/c1-8-6-10(13)3-2-9(8)7-11(16)12-14-4-5-15-12/h2-6,11,16H,7H2,1H3,(H,14,15).
What are the key properties of 2-(4-fluoro-2-methylphenyl)-1-(1H-imidazol-2-yl)ethanol?
2-(4-fluoro-2-methylphenyl)-1-(1H-imidazol-2-yl)ethanol has a molecular weight of 220.25 g/mol, XLogP of 2.13, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluoro-2-methylphenyl)-1-(1H-imidazol-2-yl)ethanol is sourced from PubChem (CID 114347532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).