7-(2,2-dimethylpropylamino)-[1,3]thiazolo[3,2-a]pyrimidin-5-one

C11H15N3OS — CID 10988301

IUPAC7-(2,2-dimethylpropylamino)-[1,3]thiazolo[3,2-a]pyrimidin-5-one
SMILESCC(C)(C)CNc1cc(=O)n2ccsc2n1
InChIInChI=1S/C11H15N3OS/c1-11(2,3)7-12-8-6-9(15)14-4-5-16-10(14)13-8/h4-6,12H,7H2,1-3H3
InChIKeyGTWZMYRGYODEQG-UHFFFAOYSA-N
MW237.33 g/mol
LogP2.21
Rot. Bonds2

About 7-(2,2-dimethylpropylamino)-[1,3]thiazolo[3,2-a]pyrimidin-5-one

7-(2,2-dimethylpropylamino)-[1,3]thiazolo[3,2-a]pyrimidin-5-one (PubChem CID 10988301) has the molecular formula C11H15N3OS and a molecular weight of 237.33 g/mol. Its IUPAC name is 7-(2,2-dimethylpropylamino)-[1,3]thiazolo[3,2-a]pyrimidin-5-one.

Molecular Properties

Compound Name7-(2,2-dimethylpropylamino)-[1,3]thiazolo[3,2-a]pyrimidin-5-one
PubChem CID10988301
Molecular FormulaC11H15N3OS
Molecular Weight237.33 g/mol
Exact Mass237.09
IUPAC Name7-(2,2-dimethylpropylamino)-[1,3]thiazolo[3,2-a]pyrimidin-5-one
SMILESCC(C)(C)CNc1cc(=O)n2ccsc2n1
InChIInChI=1S/C11H15N3OS/c1-11(2,3)7-12-8-6-9(15)14-4-5-16-10(14)13-8/h4-6,12H,7H2,1-3H3
InChIKeyGTWZMYRGYODEQG-UHFFFAOYSA-N
XLogP2.21
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.33
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 7-(2,2-dimethylpropylamino)-[1,3]thiazolo[3,2-a]pyrimidin-5-one 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 7-(2,2-dimethylpropylamino)-[1,3]thiazolo[3,2-a]pyrimidin-5-one?
The IUPAC name of 7-(2,2-dimethylpropylamino)-[1,3]thiazolo[3,2-a]pyrimidin-5-one (CID 10988301) is 7-(2,2-dimethylpropylamino)-[1,3]thiazolo[3,2-a]pyrimidin-5-one.
What is the SMILES notation for 7-(2,2-dimethylpropylamino)-[1,3]thiazolo[3,2-a]pyrimidin-5-one?
The canonical SMILES for 7-(2,2-dimethylpropylamino)-[1,3]thiazolo[3,2-a]pyrimidin-5-one is CC(C)(C)CNc1cc(=O)n2ccsc2n1.
What is the InChIKey of 7-(2,2-dimethylpropylamino)-[1,3]thiazolo[3,2-a]pyrimidin-5-one?
The InChIKey is GTWZMYRGYODEQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3OS/c1-11(2,3)7-12-8-6-9(15)14-4-5-16-10(14)13-8/h4-6,12H,7H2,1-3H3.
What are the key properties of 7-(2,2-dimethylpropylamino)-[1,3]thiazolo[3,2-a]pyrimidin-5-one?
7-(2,2-dimethylpropylamino)-[1,3]thiazolo[3,2-a]pyrimidin-5-one has a molecular weight of 237.33 g/mol, XLogP of 2.21, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2,2-dimethylpropylamino)-[1,3]thiazolo[3,2-a]pyrimidin-5-one is sourced from PubChem (CID 10988301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).