2-(3-methoxyphenyl)-1-(2-methylimidazo[5,1-b][1,3]thiazol-3-yl)ethanol

C15H16N2O2S — CID 137499570

IUPAC2-(3-methoxyphenyl)-1-(2-methylimidazo[5,1-b][1,3]thiazol-3-yl)ethanol
SMILESCOc1cccc(CC(O)c2c(C)sc3cncn23)c1
InChIInChI=1S/C15H16N2O2S/c1-10-15(17-9-16-8-14(17)20-10)13(18)7-11-4-3-5-12(6-11)19-2/h3-6,8-9,13,18H,7H2,1-2H3
InChIKeyJTGADFCZKKUJLT-UHFFFAOYSA-N
MW288.37 g/mol
LogP2.99
Rot. Bonds4

About 2-(3-methoxyphenyl)-1-(2-methylimidazo[5,1-b][1,3]thiazol-3-yl)ethanol

2-(3-methoxyphenyl)-1-(2-methylimidazo[5,1-b][1,3]thiazol-3-yl)ethanol (PubChem CID 137499570) has the molecular formula C15H16N2O2S and a molecular weight of 288.37 g/mol. Its IUPAC name is 2-(3-methoxyphenyl)-1-(2-methylimidazo[5,1-b][1,3]thiazol-3-yl)ethanol.

Molecular Properties

Compound Name2-(3-methoxyphenyl)-1-(2-methylimidazo[5,1-b][1,3]thiazol-3-yl)ethanol
PubChem CID137499570
Molecular FormulaC15H16N2O2S
Molecular Weight288.37 g/mol
Exact Mass288.09
IUPAC Name2-(3-methoxyphenyl)-1-(2-methylimidazo[5,1-b][1,3]thiazol-3-yl)ethanol
SMILESCOc1cccc(CC(O)c2c(C)sc3cncn23)c1
InChIInChI=1S/C15H16N2O2S/c1-10-15(17-9-16-8-14(17)20-10)13(18)7-11-4-3-5-12(6-11)19-2/h3-6,8-9,13,18H,7H2,1-2H3
InChIKeyJTGADFCZKKUJLT-UHFFFAOYSA-N
XLogP2.99
TPSA46.76 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.37
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyphenyl)-1-(2-methylimidazo[5,1-b][1,3]thiazol-3-yl)ethanol?
The IUPAC name of 2-(3-methoxyphenyl)-1-(2-methylimidazo[5,1-b][1,3]thiazol-3-yl)ethanol (CID 137499570) is 2-(3-methoxyphenyl)-1-(2-methylimidazo[5,1-b][1,3]thiazol-3-yl)ethanol.
What is the SMILES notation for 2-(3-methoxyphenyl)-1-(2-methylimidazo[5,1-b][1,3]thiazol-3-yl)ethanol?
The canonical SMILES for 2-(3-methoxyphenyl)-1-(2-methylimidazo[5,1-b][1,3]thiazol-3-yl)ethanol is COc1cccc(CC(O)c2c(C)sc3cncn23)c1.
What is the InChIKey of 2-(3-methoxyphenyl)-1-(2-methylimidazo[5,1-b][1,3]thiazol-3-yl)ethanol?
The InChIKey is JTGADFCZKKUJLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2S/c1-10-15(17-9-16-8-14(17)20-10)13(18)7-11-4-3-5-12(6-11)19-2/h3-6,8-9,13,18H,7H2,1-2H3.
What are the key properties of 2-(3-methoxyphenyl)-1-(2-methylimidazo[5,1-b][1,3]thiazol-3-yl)ethanol?
2-(3-methoxyphenyl)-1-(2-methylimidazo[5,1-b][1,3]thiazol-3-yl)ethanol has a molecular weight of 288.37 g/mol, XLogP of 2.99, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyphenyl)-1-(2-methylimidazo[5,1-b][1,3]thiazol-3-yl)ethanol is sourced from PubChem (CID 137499570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).