1-(3-fluorophenyl)-2-(1-propylimidazol-2-yl)ethanol

C14H17FN2O — CID 79744778

IUPAC1-(3-fluorophenyl)-2-(1-propylimidazol-2-yl)ethanol
SMILESCCCn1ccnc1CC(O)c1cccc(F)c1
InChIInChI=1S/C14H17FN2O/c1-2-7-17-8-6-16-14(17)10-13(18)11-4-3-5-12(15)9-11/h3-6,8-9,13,18H,2,7,10H2,1H3
InChIKeyYXFZEQIPDZHTLI-UHFFFAOYSA-N
MW248.30 g/mol
LogP2.71
Rot. Bonds5

About 1-(3-fluorophenyl)-2-(1-propylimidazol-2-yl)ethanol

1-(3-fluorophenyl)-2-(1-propylimidazol-2-yl)ethanol (PubChem CID 79744778) has the molecular formula C14H17FN2O and a molecular weight of 248.30 g/mol. Its IUPAC name is 1-(3-fluorophenyl)-2-(1-propylimidazol-2-yl)ethanol.

Molecular Properties

Compound Name1-(3-fluorophenyl)-2-(1-propylimidazol-2-yl)ethanol
PubChem CID79744778
Molecular FormulaC14H17FN2O
Molecular Weight248.30 g/mol
Exact Mass248.13
IUPAC Name1-(3-fluorophenyl)-2-(1-propylimidazol-2-yl)ethanol
SMILESCCCn1ccnc1CC(O)c1cccc(F)c1
InChIInChI=1S/C14H17FN2O/c1-2-7-17-8-6-16-14(17)10-13(18)11-4-3-5-12(15)9-11/h3-6,8-9,13,18H,2,7,10H2,1H3
InChIKeyYXFZEQIPDZHTLI-UHFFFAOYSA-N
XLogP2.71
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.30
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,6-difluorophenyl)-2-(1-propylimidazol-2-yl)ethanol
CID 79744137
2-(1-propylimidazol-2-yl)-1-quinoxalin-6-ylethanol
CID 79752733
1-(3-fluorophenyl)-N-[(1-propylimidazol-2-yl)methyl]ethanamine
CID 55152900
1-(3-chloro-4-iodophenyl)-2-(1-propylimidazol-2-yl)ethanol
CID 103216978
1-(3-bromo-4-chlorophenyl)-2-(1-propylimidazol-2-yl)ethanol
CID 115566560
1-(2-fluoro-5-methylphenyl)-2-(1-propylimidazol-2-yl)ethanol
CID 115820989
2-(3-fluorophenyl)sulfanyl-1-(1-propylimidazol-2-yl)ethanol
CID 66070414
1-(2,4-difluorophenyl)-3-(1-propylimidazol-2-yl)propan-2-ol
CID 79751631
1-(3,5-difluorophenyl)-3-(1-propylimidazol-2-yl)propan-2-ol
CID 79751311
1-(1-methylpyrazol-3-yl)-2-(1-propylimidazol-2-yl)ethanol
CID 79753116
N-[(3-fluorophenyl)-(1-propylimidazol-2-yl)methyl]ethanamine
CID 61317740
1-(5-chlorofuran-2-yl)-2-(1-propylimidazol-2-yl)ethanol
CID 106693891

Frequently Asked Questions

What is the IUPAC name of 1-(3-fluorophenyl)-2-(1-propylimidazol-2-yl)ethanol?
The IUPAC name of 1-(3-fluorophenyl)-2-(1-propylimidazol-2-yl)ethanol (CID 79744778) is 1-(3-fluorophenyl)-2-(1-propylimidazol-2-yl)ethanol.
What is the SMILES notation for 1-(3-fluorophenyl)-2-(1-propylimidazol-2-yl)ethanol?
The canonical SMILES for 1-(3-fluorophenyl)-2-(1-propylimidazol-2-yl)ethanol is CCCn1ccnc1CC(O)c1cccc(F)c1.
What is the InChIKey of 1-(3-fluorophenyl)-2-(1-propylimidazol-2-yl)ethanol?
The InChIKey is YXFZEQIPDZHTLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17FN2O/c1-2-7-17-8-6-16-14(17)10-13(18)11-4-3-5-12(15)9-11/h3-6,8-9,13,18H,2,7,10H2,1H3.
What are the key properties of 1-(3-fluorophenyl)-2-(1-propylimidazol-2-yl)ethanol?
1-(3-fluorophenyl)-2-(1-propylimidazol-2-yl)ethanol has a molecular weight of 248.30 g/mol, XLogP of 2.71, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluorophenyl)-2-(1-propylimidazol-2-yl)ethanol is sourced from PubChem (CID 79744778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).