3,6,6-trimethyl-5H-imidazo[2,1-b][1,3]thiazole

C8H12N2S — CID 3059697

IUPAC3,6,6-trimethyl-5H-imidazo[2,1-b][1,3]thiazole
SMILESCC1=CSC2=NC(C)(C)CN12
InChIInChI=1S/C8H12N2S/c1-6-4-11-7-9-8(2,3)5-10(6)7/h4H,5H2,1-3H3
InChIKeyUYXDCXZBCPZZSE-UHFFFAOYSA-N
MW168.26 g/mol
LogP2.04
Rot. Bonds

About 3,6,6-trimethyl-5H-imidazo[2,1-b][1,3]thiazole

3,6,6-trimethyl-5H-imidazo[2,1-b][1,3]thiazole (PubChem CID 3059697) has the molecular formula C8H12N2S and a molecular weight of 168.26 g/mol. Its IUPAC name is 3,6,6-trimethyl-5H-imidazo[2,1-b][1,3]thiazole.

Molecular Properties

Compound Name3,6,6-trimethyl-5H-imidazo[2,1-b][1,3]thiazole
PubChem CID3059697
Molecular FormulaC8H12N2S
Molecular Weight168.26 g/mol
Exact Mass168.07
IUPAC Name3,6,6-trimethyl-5H-imidazo[2,1-b][1,3]thiazole
SMILESCC1=CSC2=NC(C)(C)CN12
InChIInChI=1S/C8H12N2S/c1-6-4-11-7-9-8(2,3)5-10(6)7/h4H,5H2,1-3H3
InChIKeyUYXDCXZBCPZZSE-UHFFFAOYSA-N
XLogP2.04
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.26
LogP ≤ 52.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3,6,6-trimethyl-5H-imidazo[2,1-b][1,3]thiazole?
The IUPAC name of 3,6,6-trimethyl-5H-imidazo[2,1-b][1,3]thiazole (CID 3059697) is 3,6,6-trimethyl-5H-imidazo[2,1-b][1,3]thiazole.
What is the SMILES notation for 3,6,6-trimethyl-5H-imidazo[2,1-b][1,3]thiazole?
The canonical SMILES for 3,6,6-trimethyl-5H-imidazo[2,1-b][1,3]thiazole is CC1=CSC2=NC(C)(C)CN12.
What is the InChIKey of 3,6,6-trimethyl-5H-imidazo[2,1-b][1,3]thiazole?
The InChIKey is UYXDCXZBCPZZSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2S/c1-6-4-11-7-9-8(2,3)5-10(6)7/h4H,5H2,1-3H3.
What are the key properties of 3,6,6-trimethyl-5H-imidazo[2,1-b][1,3]thiazole?
3,6,6-trimethyl-5H-imidazo[2,1-b][1,3]thiazole has a molecular weight of 168.26 g/mol, XLogP of 2.04, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6,6-trimethyl-5H-imidazo[2,1-b][1,3]thiazole is sourced from PubChem (CID 3059697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).