2-(1-propylimidazol-2-yl)-1-quinoxalin-6-ylethanol

C16H18N4O — CID 79752733

IUPAC2-(1-propylimidazol-2-yl)-1-quinoxalin-6-ylethanol
SMILESCCCn1ccnc1CC(O)c1ccc2nccnc2c1
InChIInChI=1S/C16H18N4O/c1-2-8-20-9-7-19-16(20)11-15(21)12-3-4-13-14(10-12)18-6-5-17-13/h3-7,9-10,15,21H,2,8,11H2,1H3
InChIKeyHDPXPUSIOOSWIQ-UHFFFAOYSA-N
MW282.35 g/mol
LogP2.51
Rot. Bonds5

About 2-(1-propylimidazol-2-yl)-1-quinoxalin-6-ylethanol

2-(1-propylimidazol-2-yl)-1-quinoxalin-6-ylethanol (PubChem CID 79752733) has the molecular formula C16H18N4O and a molecular weight of 282.35 g/mol. Its IUPAC name is 2-(1-propylimidazol-2-yl)-1-quinoxalin-6-ylethanol.

Molecular Properties

Compound Name2-(1-propylimidazol-2-yl)-1-quinoxalin-6-ylethanol
PubChem CID79752733
Molecular FormulaC16H18N4O
Molecular Weight282.35 g/mol
Exact Mass282.15
IUPAC Name2-(1-propylimidazol-2-yl)-1-quinoxalin-6-ylethanol
SMILESCCCn1ccnc1CC(O)c1ccc2nccnc2c1
InChIInChI=1S/C16H18N4O/c1-2-8-20-9-7-19-16(20)11-15(21)12-3-4-13-14(10-12)18-6-5-17-13/h3-7,9-10,15,21H,2,8,11H2,1H3
InChIKeyHDPXPUSIOOSWIQ-UHFFFAOYSA-N
XLogP2.51
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.35
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(1-propylimidazol-2-yl)-1-quinoxalin-6-ylethanamine
CID 79753140
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-(3-fluorophenyl)-2-(1-propylimidazol-2-yl)ethanol
CID 79744778
1-(1-methylpyrazol-3-yl)-2-(1-propylimidazol-2-yl)ethanol
CID 79753116
1-(2,6-difluorophenyl)-2-(1-propylimidazol-2-yl)ethanol
CID 79744137
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-(2-amino-5-bromophenyl)-2-(1-propylimidazol-2-yl)ethanol
CID 82703490
1-(2-fluoro-5-methylphenyl)-2-(1-propylimidazol-2-yl)ethanol
CID 115820989
1-(2-chloro-4-methylphenyl)-2-(1-propylimidazol-2-yl)ethanol
CID 106859395
1-(2-bromo-3,4-difluorophenyl)-2-(1-propylimidazol-2-yl)ethanol
CID 107538543

Frequently Asked Questions

What is the IUPAC name of 2-(1-propylimidazol-2-yl)-1-quinoxalin-6-ylethanol?
The IUPAC name of 2-(1-propylimidazol-2-yl)-1-quinoxalin-6-ylethanol (CID 79752733) is 2-(1-propylimidazol-2-yl)-1-quinoxalin-6-ylethanol.
What is the SMILES notation for 2-(1-propylimidazol-2-yl)-1-quinoxalin-6-ylethanol?
The canonical SMILES for 2-(1-propylimidazol-2-yl)-1-quinoxalin-6-ylethanol is CCCn1ccnc1CC(O)c1ccc2nccnc2c1.
What is the InChIKey of 2-(1-propylimidazol-2-yl)-1-quinoxalin-6-ylethanol?
The InChIKey is HDPXPUSIOOSWIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O/c1-2-8-20-9-7-19-16(20)11-15(21)12-3-4-13-14(10-12)18-6-5-17-13/h3-7,9-10,15,21H,2,8,11H2,1H3.
What are the key properties of 2-(1-propylimidazol-2-yl)-1-quinoxalin-6-ylethanol?
2-(1-propylimidazol-2-yl)-1-quinoxalin-6-ylethanol has a molecular weight of 282.35 g/mol, XLogP of 2.51, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-propylimidazol-2-yl)-1-quinoxalin-6-ylethanol is sourced from PubChem (CID 79752733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).