2,5-dimethyl-5,6,7,8-tetrahydroimidazo[2,1-b][1,3]benzothiazole

C11H14N2S — CID 145044106

IUPAC2,5-dimethyl-5,6,7,8-tetrahydroimidazo[2,1-b][1,3]benzothiazole
SMILESCc1cn2c3c(sc2n1)C(C)CCC3
InChIInChI=1S/C11H14N2S/c1-7-4-3-5-9-10(7)14-11-12-8(2)6-13(9)11/h6-7H,3-5H2,1-2H3
InChIKeySGEDIIAGSONBMA-UHFFFAOYSA-N
MW206.31 g/mol
LogP3.14
Rot. Bonds

About 2,5-dimethyl-5,6,7,8-tetrahydroimidazo[2,1-b][1,3]benzothiazole

2,5-dimethyl-5,6,7,8-tetrahydroimidazo[2,1-b][1,3]benzothiazole (PubChem CID 145044106) has the molecular formula C11H14N2S and a molecular weight of 206.31 g/mol. Its IUPAC name is 2,5-dimethyl-5,6,7,8-tetrahydroimidazo[2,1-b][1,3]benzothiazole.

Molecular Properties

Compound Name2,5-dimethyl-5,6,7,8-tetrahydroimidazo[2,1-b][1,3]benzothiazole
PubChem CID145044106
Molecular FormulaC11H14N2S
Molecular Weight206.31 g/mol
Exact Mass206.09
IUPAC Name2,5-dimethyl-5,6,7,8-tetrahydroimidazo[2,1-b][1,3]benzothiazole
SMILESCc1cn2c3c(sc2n1)C(C)CCC3
InChIInChI=1S/C11H14N2S/c1-7-4-3-5-9-10(7)14-11-12-8(2)6-13(9)11/h6-7H,3-5H2,1-2H3
InChIKeySGEDIIAGSONBMA-UHFFFAOYSA-N
XLogP3.14
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.31
LogP ≤ 53.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2,5-dimethyl-5,6,7,8-tetrahydroimidazo[2,1-b][1,3]benzothiazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-5,6,7,8-tetrahydroimidazo[2,1-b][1,3]benzothiazole?
The IUPAC name of 2,5-dimethyl-5,6,7,8-tetrahydroimidazo[2,1-b][1,3]benzothiazole (CID 145044106) is 2,5-dimethyl-5,6,7,8-tetrahydroimidazo[2,1-b][1,3]benzothiazole.
What is the SMILES notation for 2,5-dimethyl-5,6,7,8-tetrahydroimidazo[2,1-b][1,3]benzothiazole?
The canonical SMILES for 2,5-dimethyl-5,6,7,8-tetrahydroimidazo[2,1-b][1,3]benzothiazole is Cc1cn2c3c(sc2n1)C(C)CCC3.
What is the InChIKey of 2,5-dimethyl-5,6,7,8-tetrahydroimidazo[2,1-b][1,3]benzothiazole?
The InChIKey is SGEDIIAGSONBMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2S/c1-7-4-3-5-9-10(7)14-11-12-8(2)6-13(9)11/h6-7H,3-5H2,1-2H3.
What are the key properties of 2,5-dimethyl-5,6,7,8-tetrahydroimidazo[2,1-b][1,3]benzothiazole?
2,5-dimethyl-5,6,7,8-tetrahydroimidazo[2,1-b][1,3]benzothiazole has a molecular weight of 206.31 g/mol, XLogP of 3.14, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-5,6,7,8-tetrahydroimidazo[2,1-b][1,3]benzothiazole is sourced from PubChem (CID 145044106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).