2-(4-fluoro-3-methylphenyl)-2-(1H-imidazol-2-yl)ethanol

C12H13FN2O — CID 68678189

IUPAC2-(4-fluoro-3-methylphenyl)-2-(1H-imidazol-2-yl)ethanol
SMILESCc1cc(C(CO)c2ncc[nH]2)ccc1F
InChIInChI=1S/C12H13FN2O/c1-8-6-9(2-3-11(8)13)10(7-16)12-14-4-5-15-12/h2-6,10,16H,7H2,1H3,(H,14,15)
InChIKeyDQMJKEBKRUIUEO-UHFFFAOYSA-N
MW220.25 g/mol
LogP1.98
Rot. Bonds3

About 2-(4-fluoro-3-methylphenyl)-2-(1H-imidazol-2-yl)ethanol

2-(4-fluoro-3-methylphenyl)-2-(1H-imidazol-2-yl)ethanol (PubChem CID 68678189) has the molecular formula C12H13FN2O and a molecular weight of 220.25 g/mol. Its IUPAC name is 2-(4-fluoro-3-methylphenyl)-2-(1H-imidazol-2-yl)ethanol.

Molecular Properties

Compound Name2-(4-fluoro-3-methylphenyl)-2-(1H-imidazol-2-yl)ethanol
PubChem CID68678189
Molecular FormulaC12H13FN2O
Molecular Weight220.25 g/mol
Exact Mass220.10
IUPAC Name2-(4-fluoro-3-methylphenyl)-2-(1H-imidazol-2-yl)ethanol
SMILESCc1cc(C(CO)c2ncc[nH]2)ccc1F
InChIInChI=1S/C12H13FN2O/c1-8-6-9(2-3-11(8)13)10(7-16)12-14-4-5-15-12/h2-6,10,16H,7H2,1H3,(H,14,15)
InChIKeyDQMJKEBKRUIUEO-UHFFFAOYSA-N
XLogP1.98
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 ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-(4-fluoro-3-methylphenyl)-2-(1H-imidazol-2-yl)ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(4-fluoro-3-methylphenyl)-2-(1H-imidazol-2-yl)acetonitrile
CID 116834529
2-(2,6-difluorophenyl)-2-(1H-imidazol-2-yl)ethanol
CID 68677003
2-(4-chloro-2-methylsulfanylphenyl)-2-(1H-imidazol-2-yl)ethanol
CID 70278030
(3,4-dimethylphenyl)-(1H-imidazol-2-yl)methanol
CID 112724089
2-(4-fluoro-3-methylphenyl)butan-1-ol
CID 82075115
(2S)-2-amino-2-(4-fluoro-3-methylphenyl)ethanol
CID 55278210
2-(4-fluoro-3-methylphenyl)-N-methyl-2-pyridin-4-ylethanamine
CID 116824907
2-(4-fluoro-3-methylphenyl)-2-piperazin-1-ylethanol
CID 62119944
N-[(2,6-difluoro-3-methylphenyl)-(1H-imidazol-2-yl)methyl]propan-1-amine
CID 82822556
5-[(4-fluoro-3-methylphenyl)-hydroxymethyl]-1H-imidazole-4-carboxylic acid
CID 116520330
(4-fluoro-3-methylphenyl)methanediol
CID 45090626
2-(4-fluoro-3-methylphenyl)-2-(2-methylpropylamino)ethanol
CID 62120119

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluoro-3-methylphenyl)-2-(1H-imidazol-2-yl)ethanol?
The IUPAC name of 2-(4-fluoro-3-methylphenyl)-2-(1H-imidazol-2-yl)ethanol (CID 68678189) is 2-(4-fluoro-3-methylphenyl)-2-(1H-imidazol-2-yl)ethanol.
What is the SMILES notation for 2-(4-fluoro-3-methylphenyl)-2-(1H-imidazol-2-yl)ethanol?
The canonical SMILES for 2-(4-fluoro-3-methylphenyl)-2-(1H-imidazol-2-yl)ethanol is Cc1cc(C(CO)c2ncc[nH]2)ccc1F.
What is the InChIKey of 2-(4-fluoro-3-methylphenyl)-2-(1H-imidazol-2-yl)ethanol?
The InChIKey is DQMJKEBKRUIUEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13FN2O/c1-8-6-9(2-3-11(8)13)10(7-16)12-14-4-5-15-12/h2-6,10,16H,7H2,1H3,(H,14,15).
What are the key properties of 2-(4-fluoro-3-methylphenyl)-2-(1H-imidazol-2-yl)ethanol?
2-(4-fluoro-3-methylphenyl)-2-(1H-imidazol-2-yl)ethanol has a molecular weight of 220.25 g/mol, XLogP of 1.98, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluoro-3-methylphenyl)-2-(1H-imidazol-2-yl)ethanol is sourced from PubChem (CID 68678189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).