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

C15H19FN2O2 — CID 104793189

IUPAC2-(2-fluoro-3-methoxyphenyl)-1-(3-propylimidazol-4-yl)ethanol
SMILESCCCn1cncc1C(O)Cc1cccc(OC)c1F
InChIInChI=1S/C15H19FN2O2/c1-3-7-18-10-17-9-12(18)13(19)8-11-5-4-6-14(20-2)15(11)16/h4-6,9-10,13,19H,3,7-8H2,1-2H3
InChIKeyJYGGIWKVBFJUPO-UHFFFAOYSA-N
MW278.33 g/mol
LogP2.72
Rot. Bonds6

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

2-(2-fluoro-3-methoxyphenyl)-1-(3-propylimidazol-4-yl)ethanol (PubChem CID 104793189) has the molecular formula C15H19FN2O2 and a molecular weight of 278.33 g/mol. Its IUPAC name is 2-(2-fluoro-3-methoxyphenyl)-1-(3-propylimidazol-4-yl)ethanol.

Molecular Properties

Compound Name2-(2-fluoro-3-methoxyphenyl)-1-(3-propylimidazol-4-yl)ethanol
PubChem CID104793189
Molecular FormulaC15H19FN2O2
Molecular Weight278.33 g/mol
Exact Mass278.14
IUPAC Name2-(2-fluoro-3-methoxyphenyl)-1-(3-propylimidazol-4-yl)ethanol
SMILESCCCn1cncc1C(O)Cc1cccc(OC)c1F
InChIInChI=1S/C15H19FN2O2/c1-3-7-18-10-17-9-12(18)13(19)8-11-5-4-6-14(20-2)15(11)16/h4-6,9-10,13,19H,3,7-8H2,1-2H3
InChIKeyJYGGIWKVBFJUPO-UHFFFAOYSA-N
XLogP2.72
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.33
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-fluoro-3-methoxyphenyl)-1-(2-propylpyrazol-3-yl)ethanol
CID 114556975
2-(2-fluoro-3-methoxyphenyl)-1-(2-methylpyrazol-3-yl)ethanol
CID 114554076
2-(4-fluoro-2-methylphenyl)-1-(3-propylimidazol-4-yl)ethanol
CID 114346924
2-(3-methoxyphenyl)-1-(3-propylimidazol-4-yl)ethanol
CID 66131044
1-(2-ethylpyrazol-3-yl)-2-(2-fluoro-3-methoxyphenyl)ethanol
CID 114556790
(5-fluoro-2-methoxyphenyl)-(3-propylimidazol-4-yl)methanol
CID 82769158
1-(3-ethylimidazol-4-yl)-2-(2-methoxy-5-methylphenyl)ethanol
CID 66133516
2-(2-fluoro-3-methoxyphenyl)-1-pyrimidin-2-ylethanol
CID 104793572
2-(3-methylphenyl)-1-(3-propylimidazol-4-yl)ethanol
CID 66129442
2-(2-fluoro-3-methoxyphenyl)-1-(2H-triazol-4-yl)ethanol
CID 104793687
2-(2-methoxyphenyl)-1-(3-propan-2-ylimidazol-4-yl)ethanol
CID 66162236
2-(2-fluoro-3-methoxyphenyl)-1-(5-methyl-2-pyridinyl)ethanol
CID 104793222

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluoro-3-methoxyphenyl)-1-(3-propylimidazol-4-yl)ethanol?
The IUPAC name of 2-(2-fluoro-3-methoxyphenyl)-1-(3-propylimidazol-4-yl)ethanol (CID 104793189) is 2-(2-fluoro-3-methoxyphenyl)-1-(3-propylimidazol-4-yl)ethanol.
What is the SMILES notation for 2-(2-fluoro-3-methoxyphenyl)-1-(3-propylimidazol-4-yl)ethanol?
The canonical SMILES for 2-(2-fluoro-3-methoxyphenyl)-1-(3-propylimidazol-4-yl)ethanol is CCCn1cncc1C(O)Cc1cccc(OC)c1F.
What is the InChIKey of 2-(2-fluoro-3-methoxyphenyl)-1-(3-propylimidazol-4-yl)ethanol?
The InChIKey is JYGGIWKVBFJUPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FN2O2/c1-3-7-18-10-17-9-12(18)13(19)8-11-5-4-6-14(20-2)15(11)16/h4-6,9-10,13,19H,3,7-8H2,1-2H3.
What are the key properties of 2-(2-fluoro-3-methoxyphenyl)-1-(3-propylimidazol-4-yl)ethanol?
2-(2-fluoro-3-methoxyphenyl)-1-(3-propylimidazol-4-yl)ethanol has a molecular weight of 278.33 g/mol, XLogP of 2.72, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluoro-3-methoxyphenyl)-1-(3-propylimidazol-4-yl)ethanol is sourced from PubChem (CID 104793189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).