2-(6-tert-butyl-3-thiophen-2-ylimidazo[2,1-b][1,3]thiazol-5-yl)ethanamine

C15H19N3S2 — CID 82062518

IUPAC2-(6-tert-butyl-3-thiophen-2-ylimidazo[2,1-b][1,3]thiazol-5-yl)ethanamine
SMILESCC(C)(C)c1nc2scc(-c3cccs3)n2c1CCN
InChIInChI=1S/C15H19N3S2/c1-15(2,3)13-10(6-7-16)18-11(9-20-14(18)17-13)12-5-4-8-19-12/h4-5,8-9H,6-7,16H2,1-3H3
InChIKeyDJKOBLIZWHZEIG-UHFFFAOYSA-N
MW305.47 g/mol
LogP3.92
Rot. Bonds3

About 2-(6-tert-butyl-3-thiophen-2-ylimidazo[2,1-b][1,3]thiazol-5-yl)ethanamine

2-(6-tert-butyl-3-thiophen-2-ylimidazo[2,1-b][1,3]thiazol-5-yl)ethanamine (PubChem CID 82062518) has the molecular formula C15H19N3S2 and a molecular weight of 305.47 g/mol. Its IUPAC name is 2-(6-tert-butyl-3-thiophen-2-ylimidazo[2,1-b][1,3]thiazol-5-yl)ethanamine.

Molecular Properties

Compound Name2-(6-tert-butyl-3-thiophen-2-ylimidazo[2,1-b][1,3]thiazol-5-yl)ethanamine
PubChem CID82062518
Molecular FormulaC15H19N3S2
Molecular Weight305.47 g/mol
Exact Mass305.10
IUPAC Name2-(6-tert-butyl-3-thiophen-2-ylimidazo[2,1-b][1,3]thiazol-5-yl)ethanamine
SMILESCC(C)(C)c1nc2scc(-c3cccs3)n2c1CCN
InChIInChI=1S/C15H19N3S2/c1-15(2,3)13-10(6-7-16)18-11(9-20-14(18)17-13)12-5-4-8-19-12/h4-5,8-9H,6-7,16H2,1-3H3
InChIKeyDJKOBLIZWHZEIG-UHFFFAOYSA-N
XLogP3.92
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.47
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[6-tert-butyl-3-(4-methylphenyl)imidazo[2,1-b][1,3]thiazol-5-yl]ethanamine
CID 93210774
2-(3-pyridin-4-yl-6-thiophen-2-ylimidazo[2,1-b][1,3]thiazol-5-yl)ethanamine
CID 82062566
2-(5-thiophen-2-yl-[1,3]thiazolo[2,3-c][1,2,4]triazol-3-yl)ethanamine
CID 82166922
2-(3-pyridin-3-yl-6-thiophen-2-ylimidazo[2,1-b][1,3]thiazol-5-yl)ethanamine
CID 82062562
[6-(4-methoxyphenyl)-3-thiophen-2-ylimidazo[2,1-b][1,3]thiazol-5-yl]methanamine
CID 39196674
[6-tert-butyl-3-(4-fluorophenyl)imidazo[2,1-b][1,3]thiazol-5-yl]methanamine
CID 39196560
[3-(4-fluorophenyl)-6-thiophen-2-ylimidazo[2,1-b][1,3]thiazol-5-yl]methanamine
CID 39196558
(6-thiophen-2-yl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)methanamine
CID 82291683
2-[3-(4-bromophenyl)-6-methylimidazo[2,1-b][1,3]thiazol-5-yl]ethanamine
CID 39194860
2-[6-tert-butyl-3-(2,4-dimethylphenyl)imidazo[2,1-b][1,3]thiazol-5-yl]acetonitrile
CID 82062412
2-[3-(2-methoxyphenyl)-6-methylimidazo[2,1-b][1,3]thiazol-5-yl]ethanamine
CID 39194918
2-[3-(4-fluorophenyl)-6-propan-2-ylimidazo[2,1-b][1,3]thiazol-5-yl]ethanamine
CID 82062511

Frequently Asked Questions

What is the IUPAC name of 2-(6-tert-butyl-3-thiophen-2-ylimidazo[2,1-b][1,3]thiazol-5-yl)ethanamine?
The IUPAC name of 2-(6-tert-butyl-3-thiophen-2-ylimidazo[2,1-b][1,3]thiazol-5-yl)ethanamine (CID 82062518) is 2-(6-tert-butyl-3-thiophen-2-ylimidazo[2,1-b][1,3]thiazol-5-yl)ethanamine.
What is the SMILES notation for 2-(6-tert-butyl-3-thiophen-2-ylimidazo[2,1-b][1,3]thiazol-5-yl)ethanamine?
The canonical SMILES for 2-(6-tert-butyl-3-thiophen-2-ylimidazo[2,1-b][1,3]thiazol-5-yl)ethanamine is CC(C)(C)c1nc2scc(-c3cccs3)n2c1CCN.
What is the InChIKey of 2-(6-tert-butyl-3-thiophen-2-ylimidazo[2,1-b][1,3]thiazol-5-yl)ethanamine?
The InChIKey is DJKOBLIZWHZEIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3S2/c1-15(2,3)13-10(6-7-16)18-11(9-20-14(18)17-13)12-5-4-8-19-12/h4-5,8-9H,6-7,16H2,1-3H3.
What are the key properties of 2-(6-tert-butyl-3-thiophen-2-ylimidazo[2,1-b][1,3]thiazol-5-yl)ethanamine?
2-(6-tert-butyl-3-thiophen-2-ylimidazo[2,1-b][1,3]thiazol-5-yl)ethanamine has a molecular weight of 305.47 g/mol, XLogP of 3.92, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-tert-butyl-3-thiophen-2-ylimidazo[2,1-b][1,3]thiazol-5-yl)ethanamine is sourced from PubChem (CID 82062518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).