1-(4-ethoxyoxan-4-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanol

C14H20N2O3S — CID 116754112

IUPAC1-(4-ethoxyoxan-4-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanol
SMILESCCOC1(C(O)Cc2cn3ccsc3n2)CCOCC1
InChIInChI=1S/C14H20N2O3S/c1-2-19-14(3-6-18-7-4-14)12(17)9-11-10-16-5-8-20-13(16)15-11/h5,8,10,12,17H,2-4,6-7,9H2,1H3
InChIKeyYXFNPIINYONZEF-UHFFFAOYSA-N
MW296.39 g/mol
LogP1.88
Rot. Bonds5

About 1-(4-ethoxyoxan-4-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanol

1-(4-ethoxyoxan-4-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanol (PubChem CID 116754112) has the molecular formula C14H20N2O3S and a molecular weight of 296.39 g/mol. Its IUPAC name is 1-(4-ethoxyoxan-4-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanol.

Molecular Properties

Compound Name1-(4-ethoxyoxan-4-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanol
PubChem CID116754112
Molecular FormulaC14H20N2O3S
Molecular Weight296.39 g/mol
Exact Mass296.12
IUPAC Name1-(4-ethoxyoxan-4-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanol
SMILESCCOC1(C(O)Cc2cn3ccsc3n2)CCOCC1
InChIInChI=1S/C14H20N2O3S/c1-2-19-14(3-6-18-7-4-14)12(17)9-11-10-16-5-8-20-13(16)15-11/h5,8,10,12,17H,2-4,6-7,9H2,1H3
InChIKeyYXFNPIINYONZEF-UHFFFAOYSA-N
XLogP1.88
TPSA55.99 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.39
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-(1-ethoxy-3-methylcyclohexyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanol
CID 116755144
1-(1-ethoxycyclopentyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanamine
CID 116761822
N-[[4-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)oxan-4-yl]methyl]ethanamine
CID 115334374
2-imidazo[2,1-b][1,3]thiazol-6-yl-N-methyl-1-(oxan-4-yl)ethanamine
CID 115333735
6-(3-chloro-2-methylpentyl)imidazo[2,1-b][1,3]thiazole
CID 115334174
[4-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)oxan-4-yl]methanamine
CID 113289332
methyl 2-hydroxy-3-imidazo[2,1-b][1,3]thiazol-6-ylpropanoate
CID 115332918
1-imidazo[2,1-b][1,3]thiazol-6-yl-3-methylsulfanylpropan-2-ol
CID 115333257
2-(4,5-dimethyl-1,3-thiazol-2-yl)-1-(4-ethoxyoxan-4-yl)ethanol
CID 116754344
1-(dimethylamino)-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-ol
CID 115333340
1-imidazo[2,1-b][1,3]thiazol-6-yl-3-propylhexan-2-amine
CID 105023692
3-cyclopropyl-1-imidazo[2,1-b][1,3]thiazol-6-ylbutan-2-ol
CID 115828299

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethoxyoxan-4-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanol?
The IUPAC name of 1-(4-ethoxyoxan-4-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanol (CID 116754112) is 1-(4-ethoxyoxan-4-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanol.
What is the SMILES notation for 1-(4-ethoxyoxan-4-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanol?
The canonical SMILES for 1-(4-ethoxyoxan-4-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanol is CCOC1(C(O)Cc2cn3ccsc3n2)CCOCC1.
What is the InChIKey of 1-(4-ethoxyoxan-4-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanol?
The InChIKey is YXFNPIINYONZEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3S/c1-2-19-14(3-6-18-7-4-14)12(17)9-11-10-16-5-8-20-13(16)15-11/h5,8,10,12,17H,2-4,6-7,9H2,1H3.
What are the key properties of 1-(4-ethoxyoxan-4-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanol?
1-(4-ethoxyoxan-4-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanol has a molecular weight of 296.39 g/mol, XLogP of 1.88, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethoxyoxan-4-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanol is sourced from PubChem (CID 116754112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).