(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methanamine

C8H11N3S — CID 39195460

IUPAC(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methanamine
SMILESCc1nc2scc(C)n2c1CN
InChIInChI=1S/C8H11N3S/c1-5-4-12-8-10-6(2)7(3-9)11(5)8/h4H,3,9H2,1-2H3
InChIKeyPKJMVADXUPVZMT-UHFFFAOYSA-N
MW181.26 g/mol
LogP1.47
Rot. Bonds1

About (3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methanamine

(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methanamine (PubChem CID 39195460) has the molecular formula C8H11N3S and a molecular weight of 181.26 g/mol. Its IUPAC name is (3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methanamine.

Molecular Properties

Compound Name(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methanamine
PubChem CID39195460
Molecular FormulaC8H11N3S
Molecular Weight181.26 g/mol
Exact Mass181.07
IUPAC Name(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methanamine
SMILESCc1nc2scc(C)n2c1CN
InChIInChI=1S/C8H11N3S/c1-5-4-12-8-10-6(2)7(3-9)11(5)8/h4H,3,9H2,1-2H3
InChIKeyPKJMVADXUPVZMT-UHFFFAOYSA-N
XLogP1.47
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.26
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methanamine?
The IUPAC name of (3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methanamine (CID 39195460) is (3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methanamine.
What is the SMILES notation for (3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methanamine?
The canonical SMILES for (3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methanamine is Cc1nc2scc(C)n2c1CN.
What is the InChIKey of (3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methanamine?
The InChIKey is PKJMVADXUPVZMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3S/c1-5-4-12-8-10-6(2)7(3-9)11(5)8/h4H,3,9H2,1-2H3.
What are the key properties of (3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methanamine?
(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methanamine has a molecular weight of 181.26 g/mol, XLogP of 1.47, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)methanamine is sourced from PubChem (CID 39195460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).