1-(2,6-difluorophenyl)-2-(1-propylimidazol-2-yl)ethanol

C14H16F2N2O — CID 79744137

IUPAC1-(2,6-difluorophenyl)-2-(1-propylimidazol-2-yl)ethanol
SMILESCCCn1ccnc1CC(O)c1c(F)cccc1F
InChIInChI=1S/C14H16F2N2O/c1-2-7-18-8-6-17-13(18)9-12(19)14-10(15)4-3-5-11(14)16/h3-6,8,12,19H,2,7,9H2,1H3
InChIKeyDDJOVVGMWANJDB-UHFFFAOYSA-N
MW266.29 g/mol
LogP2.85
Rot. Bonds5

About 1-(2,6-difluorophenyl)-2-(1-propylimidazol-2-yl)ethanol

1-(2,6-difluorophenyl)-2-(1-propylimidazol-2-yl)ethanol (PubChem CID 79744137) has the molecular formula C14H16F2N2O and a molecular weight of 266.29 g/mol. Its IUPAC name is 1-(2,6-difluorophenyl)-2-(1-propylimidazol-2-yl)ethanol.

Molecular Properties

Compound Name1-(2,6-difluorophenyl)-2-(1-propylimidazol-2-yl)ethanol
PubChem CID79744137
Molecular FormulaC14H16F2N2O
Molecular Weight266.29 g/mol
Exact Mass266.12
IUPAC Name1-(2,6-difluorophenyl)-2-(1-propylimidazol-2-yl)ethanol
SMILESCCCn1ccnc1CC(O)c1c(F)cccc1F
InChIInChI=1S/C14H16F2N2O/c1-2-7-18-8-6-17-13(18)9-12(19)14-10(15)4-3-5-11(14)16/h3-6,8,12,19H,2,7,9H2,1H3
InChIKeyDDJOVVGMWANJDB-UHFFFAOYSA-N
XLogP2.85
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.29
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-fluorophenyl)-2-(1-propylimidazol-2-yl)ethanol
CID 79744778
1-(2-bromo-3,4-difluorophenyl)-2-(1-propylimidazol-2-yl)ethanol
CID 107538543
1-(2-fluoro-5-methylphenyl)-2-(1-propylimidazol-2-yl)ethanol
CID 115820989
1-(1-methylpyrazol-3-yl)-2-(1-propylimidazol-2-yl)ethanol
CID 79753116
2-(1-ethylimidazol-2-yl)-1-(2-fluorophenyl)ethanol
CID 79744598
1-(1-methylimidazol-4-yl)-2-(1-propylimidazol-2-yl)ethanol
CID 107978538
1-(5-chlorofuran-2-yl)-2-(1-propylimidazol-2-yl)ethanol
CID 106693891
1-(5-chloro-1-methylimidazol-2-yl)-2-(1-propylimidazol-2-yl)ethanol
CID 114239445
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
2-(1-propylimidazol-2-yl)-1-quinoxalin-6-ylethanol
CID 79752733
[1-(2-chloro-6-fluorophenyl)-3-(1-propylimidazol-2-yl)propan-2-yl]hydrazine
CID 105216048

Frequently Asked Questions

What is the IUPAC name of 1-(2,6-difluorophenyl)-2-(1-propylimidazol-2-yl)ethanol?
The IUPAC name of 1-(2,6-difluorophenyl)-2-(1-propylimidazol-2-yl)ethanol (CID 79744137) is 1-(2,6-difluorophenyl)-2-(1-propylimidazol-2-yl)ethanol.
What is the SMILES notation for 1-(2,6-difluorophenyl)-2-(1-propylimidazol-2-yl)ethanol?
The canonical SMILES for 1-(2,6-difluorophenyl)-2-(1-propylimidazol-2-yl)ethanol is CCCn1ccnc1CC(O)c1c(F)cccc1F.
What is the InChIKey of 1-(2,6-difluorophenyl)-2-(1-propylimidazol-2-yl)ethanol?
The InChIKey is DDJOVVGMWANJDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16F2N2O/c1-2-7-18-8-6-17-13(18)9-12(19)14-10(15)4-3-5-11(14)16/h3-6,8,12,19H,2,7,9H2,1H3.
What are the key properties of 1-(2,6-difluorophenyl)-2-(1-propylimidazol-2-yl)ethanol?
1-(2,6-difluorophenyl)-2-(1-propylimidazol-2-yl)ethanol has a molecular weight of 266.29 g/mol, XLogP of 2.85, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-difluorophenyl)-2-(1-propylimidazol-2-yl)ethanol is sourced from PubChem (CID 79744137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).