2-(4-fluoro-2-methylphenyl)-1-(3-propylimidazol-4-yl)ethanol

C15H19FN2O — CID 114346924

IUPAC2-(4-fluoro-2-methylphenyl)-1-(3-propylimidazol-4-yl)ethanol
SMILESCCCn1cncc1C(O)Cc1ccc(F)cc1C
InChIInChI=1S/C15H19FN2O/c1-3-6-18-10-17-9-14(18)15(19)8-12-4-5-13(16)7-11(12)2/h4-5,7,9-10,15,19H,3,6,8H2,1-2H3
InChIKeyQJGWAVZRDOXFSH-UHFFFAOYSA-N
MW262.33 g/mol
LogP3.02
Rot. Bonds5

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

2-(4-fluoro-2-methylphenyl)-1-(3-propylimidazol-4-yl)ethanol (PubChem CID 114346924) has the molecular formula C15H19FN2O and a molecular weight of 262.33 g/mol. Its IUPAC name is 2-(4-fluoro-2-methylphenyl)-1-(3-propylimidazol-4-yl)ethanol.

Molecular Properties

Compound Name2-(4-fluoro-2-methylphenyl)-1-(3-propylimidazol-4-yl)ethanol
PubChem CID114346924
Molecular FormulaC15H19FN2O
Molecular Weight262.33 g/mol
Exact Mass262.15
IUPAC Name2-(4-fluoro-2-methylphenyl)-1-(3-propylimidazol-4-yl)ethanol
SMILESCCCn1cncc1C(O)Cc1ccc(F)cc1C
InChIInChI=1S/C15H19FN2O/c1-3-6-18-10-17-9-14(18)15(19)8-12-4-5-13(16)7-11(12)2/h4-5,7,9-10,15,19H,3,6,8H2,1-2H3
InChIKeyQJGWAVZRDOXFSH-UHFFFAOYSA-N
XLogP3.02
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.33
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-bromo-5-fluorophenyl)-1-(3-propylimidazol-4-yl)ethanol
CID 66131048
(2,5-difluorophenyl)-(3-propylimidazol-4-yl)methanol
CID 66132426
2-(2-fluoro-3-methoxyphenyl)-1-(3-propylimidazol-4-yl)ethanol
CID 104793189
1-(3-ethyl-1-methylpyrazol-5-yl)-2-(4-fluoro-2-methylphenyl)ethanol
CID 105131290
2-(3-methylphenyl)-1-(3-propylimidazol-4-yl)ethanol
CID 66129442
(3,5-difluorophenyl)-(3-propylimidazol-4-yl)methanol
CID 66131636
(5-fluoro-2-methoxyphenyl)-(3-propylimidazol-4-yl)methanol
CID 82769158
2-(2,5-dimethylpyrazol-3-yl)-1-(3-propylimidazol-4-yl)ethanol
CID 66131633
2-(2-ethyl-5-methylpyrazol-3-yl)-1-(3-propylimidazol-4-yl)ethanol
CID 66131436
(3,4-difluorophenyl)-(3-propylimidazol-4-yl)methanol
CID 66129636
2-(3-methoxyphenyl)-1-(3-propylimidazol-4-yl)ethanol
CID 66131044
2-(4-bromo-1,3-dimethylpyrazol-5-yl)-1-(3-propylimidazol-4-yl)ethanol
CID 66129440

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluoro-2-methylphenyl)-1-(3-propylimidazol-4-yl)ethanol?
The IUPAC name of 2-(4-fluoro-2-methylphenyl)-1-(3-propylimidazol-4-yl)ethanol (CID 114346924) is 2-(4-fluoro-2-methylphenyl)-1-(3-propylimidazol-4-yl)ethanol.
What is the SMILES notation for 2-(4-fluoro-2-methylphenyl)-1-(3-propylimidazol-4-yl)ethanol?
The canonical SMILES for 2-(4-fluoro-2-methylphenyl)-1-(3-propylimidazol-4-yl)ethanol is CCCn1cncc1C(O)Cc1ccc(F)cc1C.
What is the InChIKey of 2-(4-fluoro-2-methylphenyl)-1-(3-propylimidazol-4-yl)ethanol?
The InChIKey is QJGWAVZRDOXFSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FN2O/c1-3-6-18-10-17-9-14(18)15(19)8-12-4-5-13(16)7-11(12)2/h4-5,7,9-10,15,19H,3,6,8H2,1-2H3.
What are the key properties of 2-(4-fluoro-2-methylphenyl)-1-(3-propylimidazol-4-yl)ethanol?
2-(4-fluoro-2-methylphenyl)-1-(3-propylimidazol-4-yl)ethanol has a molecular weight of 262.33 g/mol, XLogP of 3.02, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluoro-2-methylphenyl)-1-(3-propylimidazol-4-yl)ethanol is sourced from PubChem (CID 114346924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).