2-(1-ethylimidazol-2-yl)-1-quinolin-5-ylethanol

C16H17N3O — CID 105112369

IUPAC2-(1-ethylimidazol-2-yl)-1-quinolin-5-ylethanol
SMILESCCn1ccnc1CC(O)c1cccc2ncccc12
InChIInChI=1S/C16H17N3O/c1-2-19-10-9-18-16(19)11-15(20)13-5-3-7-14-12(13)6-4-8-17-14/h3-10,15,20H,2,11H2,1H3
InChIKeyVITLTJLECLYMFL-UHFFFAOYSA-N
MW267.33 g/mol
LogP2.73
Rot. Bonds4

About 2-(1-ethylimidazol-2-yl)-1-quinolin-5-ylethanol

2-(1-ethylimidazol-2-yl)-1-quinolin-5-ylethanol (PubChem CID 105112369) has the molecular formula C16H17N3O and a molecular weight of 267.33 g/mol. Its IUPAC name is 2-(1-ethylimidazol-2-yl)-1-quinolin-5-ylethanol.

Molecular Properties

Compound Name2-(1-ethylimidazol-2-yl)-1-quinolin-5-ylethanol
PubChem CID105112369
Molecular FormulaC16H17N3O
Molecular Weight267.33 g/mol
Exact Mass267.14
IUPAC Name2-(1-ethylimidazol-2-yl)-1-quinolin-5-ylethanol
SMILESCCn1ccnc1CC(O)c1cccc2ncccc12
InChIInChI=1S/C16H17N3O/c1-2-19-10-9-18-16(19)11-15(20)13-5-3-7-14-12(13)6-4-8-17-14/h3-10,15,20H,2,11H2,1H3
InChIKeyVITLTJLECLYMFL-UHFFFAOYSA-N
XLogP2.73
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1-methylimidazol-2-yl)-1-quinolin-5-ylethanol
CID 105113593
2-(2-ethyl-1,2,4-triazol-3-yl)-1-quinolin-5-ylethanol
CID 105109180
2-(1-ethylimidazol-2-yl)-1-(2-iodophenyl)ethanol
CID 115819308
2-(1-ethylimidazol-2-yl)-1-(2-fluorophenyl)ethanol
CID 79744598
2-(2-methyl-1,2,4-triazol-3-yl)-1-quinolin-5-ylethanol
CID 105107161
1-(2-tert-butylphenyl)-2-(1-ethylimidazol-2-yl)ethanol
CID 115819265
[2-(1-ethylimidazol-2-yl)-1-naphthalen-1-ylethyl]hydrazine
CID 105213300
2-(1-ethylimidazol-2-yl)-1-pyridin-2-ylethanol
CID 79743859
2-(1-ethylimidazol-2-yl)-1-quinolin-5-ylethanone
CID 105115236
[2-(1-ethylimidazol-2-yl)-1-quinoxalin-5-ylethyl]hydrazine
CID 105321872
2-(1-ethylimidazol-2-yl)-1-(2-methoxy-5-methylphenyl)ethanol
CID 115819361
2-(1-ethylimidazol-2-yl)-1-pyrazolo[1,5-a]pyridin-3-ylethanol
CID 103129027

Frequently Asked Questions

What is the IUPAC name of 2-(1-ethylimidazol-2-yl)-1-quinolin-5-ylethanol?
The IUPAC name of 2-(1-ethylimidazol-2-yl)-1-quinolin-5-ylethanol (CID 105112369) is 2-(1-ethylimidazol-2-yl)-1-quinolin-5-ylethanol.
What is the SMILES notation for 2-(1-ethylimidazol-2-yl)-1-quinolin-5-ylethanol?
The canonical SMILES for 2-(1-ethylimidazol-2-yl)-1-quinolin-5-ylethanol is CCn1ccnc1CC(O)c1cccc2ncccc12.
What is the InChIKey of 2-(1-ethylimidazol-2-yl)-1-quinolin-5-ylethanol?
The InChIKey is VITLTJLECLYMFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O/c1-2-19-10-9-18-16(19)11-15(20)13-5-3-7-14-12(13)6-4-8-17-14/h3-10,15,20H,2,11H2,1H3.
What are the key properties of 2-(1-ethylimidazol-2-yl)-1-quinolin-5-ylethanol?
2-(1-ethylimidazol-2-yl)-1-quinolin-5-ylethanol has a molecular weight of 267.33 g/mol, XLogP of 2.73, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethylimidazol-2-yl)-1-quinolin-5-ylethanol is sourced from PubChem (CID 105112369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).