1-(3,5-dimethylphenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanol

C15H16N2OS — CID 115332851

IUPAC1-(3,5-dimethylphenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanol
SMILESCc1cc(C)cc(C(O)Cc2cn3ccsc3n2)c1
InChIInChI=1S/C15H16N2OS/c1-10-5-11(2)7-12(6-10)14(18)8-13-9-17-3-4-19-15(17)16-13/h3-7,9,14,18H,8H2,1-2H3
InChIKeyNPFIYDVRLVNWBQ-UHFFFAOYSA-N
MW272.37 g/mol
LogP3.29
Rot. Bonds3

About 1-(3,5-dimethylphenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanol

1-(3,5-dimethylphenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanol (PubChem CID 115332851) has the molecular formula C15H16N2OS and a molecular weight of 272.37 g/mol. Its IUPAC name is 1-(3,5-dimethylphenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanol.

Molecular Properties

Compound Name1-(3,5-dimethylphenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanol
PubChem CID115332851
Molecular FormulaC15H16N2OS
Molecular Weight272.37 g/mol
Exact Mass272.10
IUPAC Name1-(3,5-dimethylphenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanol
SMILESCc1cc(C)cc(C(O)Cc2cn3ccsc3n2)c1
InChIInChI=1S/C15H16N2OS/c1-10-5-11(2)7-12(6-10)14(18)8-13-9-17-3-4-19-15(17)16-13/h3-7,9,14,18H,8H2,1-2H3
InChIKeyNPFIYDVRLVNWBQ-UHFFFAOYSA-N
XLogP3.29
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.37
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[1-(3,5-dimethylphenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethyl]hydrazine
CID 105328770
1-(4-chloro-3-methylphenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanol
CID 115828301
2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(5-iodothiophen-3-yl)ethanol
CID 115828284
2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(4-methylsulfanylphenyl)ethanol
CID 115828185
1-(2,5-dimethylthiophen-3-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanol
CID 115332858
1-(furan-3-yl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanol
CID 115332847
2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(4-methyl-1,3-thiazol-2-yl)ethanol
CID 104769476
2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(3-iodophenyl)ethanol
CID 115828163
2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(2-methylphenyl)ethanol
CID 115332824
2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(2-methoxy-4-methylphenyl)ethanol
CID 106791040
2-imidazo[2,1-b][1,3]thiazol-6-yl-1-(4-propylthiadiazol-5-yl)ethanol
CID 105120489
1-(2,5-dimethylphenyl)-3-imidazo[2,1-b][1,3]thiazol-6-ylpropan-2-ol
CID 115828306

Frequently Asked Questions

What is the IUPAC name of 1-(3,5-dimethylphenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanol?
The IUPAC name of 1-(3,5-dimethylphenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanol (CID 115332851) is 1-(3,5-dimethylphenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanol.
What is the SMILES notation for 1-(3,5-dimethylphenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanol?
The canonical SMILES for 1-(3,5-dimethylphenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanol is Cc1cc(C)cc(C(O)Cc2cn3ccsc3n2)c1.
What is the InChIKey of 1-(3,5-dimethylphenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanol?
The InChIKey is NPFIYDVRLVNWBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2OS/c1-10-5-11(2)7-12(6-10)14(18)8-13-9-17-3-4-19-15(17)16-13/h3-7,9,14,18H,8H2,1-2H3.
What are the key properties of 1-(3,5-dimethylphenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanol?
1-(3,5-dimethylphenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanol has a molecular weight of 272.37 g/mol, XLogP of 3.29, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-dimethylphenyl)-2-imidazo[2,1-b][1,3]thiazol-6-ylethanol is sourced from PubChem (CID 115332851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).