3-(4-ethoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole

C13H14N2OS — CID 686784

IUPAC3-(4-ethoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole
SMILESCCOc1ccc(C2=CSC3=NCCN23)cc1
InChIInChI=1S/C13H14N2OS/c1-2-16-11-5-3-10(4-6-11)12-9-17-13-14-7-8-15(12)13/h3-6,9H,2,7-8H2,1H3
InChIKeyVASVSOBQTRKFFH-UHFFFAOYSA-N
MW246.34 g/mol
LogP2.80
Rot. Bonds3

About 3-(4-ethoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole

3-(4-ethoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole (PubChem CID 686784) has the molecular formula C13H14N2OS and a molecular weight of 246.34 g/mol. Its IUPAC name is 3-(4-ethoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole.

Molecular Properties

Compound Name3-(4-ethoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole
PubChem CID686784
Molecular FormulaC13H14N2OS
Molecular Weight246.34 g/mol
Exact Mass246.08
IUPAC Name3-(4-ethoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole
SMILESCCOc1ccc(C2=CSC3=NCCN23)cc1
InChIInChI=1S/C13H14N2OS/c1-2-16-11-5-3-10(4-6-11)12-9-17-13-14-7-8-15(12)13/h3-6,9H,2,7-8H2,1H3
InChIKeyVASVSOBQTRKFFH-UHFFFAOYSA-N
XLogP2.80
TPSA24.83 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.34
LogP ≤ 52.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

Imidazo(2,1-b)thiazole, 5,6-dihydro-3-(4-propoxyphenyl)-, monohydrochloride
CID 3076280
3-(4-Ethoxy-3-nitrophenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole
CID 715069
3-(3-Nitro-4-propoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole
CID 1557510
3-(3-Chloro-4-methoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole
CID 720498
3-(3,4-Dimethoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole;hydrobromide
CID 23724178
3-(3-Chloro-4-ethoxy-phenyl)-5,6-dihydro-imidazo[2,1-b]thiazole
CID 715067
3-(3-Chloro-4-propoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole
CID 2041467
3-(4-Methoxyphenyl)-2-methyl-5,6-dihydroimidazo[2,1-b]thiazole hydrobromide
CID 16237819
4-(5,6-Dihydroimidazo[2,1-b][1,3]thiazol-3-yl)-2-fluorophenyl methyl ether hydrobromide
CID 2858220
3-(4-Methoxy-phenyl)-5,6-dihydro-imidazo(2,1-B)thiazole, hydrobromide
CID 15563881
3-(3-Bromo-4-methoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole;hydrobromide
CID 23723153
3-[3-(4-Methoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]propanoic acid;hydrochloride
CID 23724188

Frequently Asked Questions

What is the IUPAC name of 3-(4-ethoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole?
The IUPAC name of 3-(4-ethoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole (CID 686784) is 3-(4-ethoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole.
What is the SMILES notation for 3-(4-ethoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole?
The canonical SMILES for 3-(4-ethoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole is CCOc1ccc(C2=CSC3=NCCN23)cc1.
What is the InChIKey of 3-(4-ethoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole?
The InChIKey is VASVSOBQTRKFFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2OS/c1-2-16-11-5-3-10(4-6-11)12-9-17-13-14-7-8-15(12)13/h3-6,9H,2,7-8H2,1H3.
What are the key properties of 3-(4-ethoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole?
3-(4-ethoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole has a molecular weight of 246.34 g/mol, XLogP of 2.80, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-ethoxyphenyl)-5,6-dihydroimidazo[2,1-b][1,3]thiazole is sourced from PubChem (CID 686784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).