2-(7-tert-butyl-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-3-yl)-N-cyclopentylacetamide

C17H25N3O2S — CID 16868818

About 2-(7-tert-butyl-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-3-yl)-N-cyclopentylacetamide

2-(7-tert-butyl-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-3-yl)-N-cyclopentylacetamide (PubChem CID 16868818) has the molecular formula C17H25N3O2S and a molecular weight of 335.47 g/mol. Its IUPAC name is 2-(7-tert-butyl-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-3-yl)-N-cyclopentylacetamide.

Molecular Properties

• Compound Name: 2-(7-tert-butyl-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-3-yl)-N-cyclopentylacetamide
• PubChem CID: 16868818
• Molecular Formula: C17H25N3O2S
• Molecular Weight: 335.47 g/mol
• Exact Mass: 335.17
• IUPAC Name: 2-(7-tert-butyl-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-3-yl)-N-cyclopentylacetamide
• SMILES: CC(C)(C)c1cc(=O)n2c(n1)SCC2CC(=O)NC1CCCC1
• InChI: InChI=1S/C17H25N3O2S/c1-17(2,3)13-9-15(22)20-12(10-23-16(20)19-13)8-14(21)18-11-6-4-5-7-11/h9,11-12H,4-8,10H2,1-3H3,(H,18,21)
• InChIKey: UGHJHJZPSFXUPV-UHFFFAOYSA-N
• XLogP: 2.64
• TPSA: 63.99 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 3
• Heavy Atoms: 23
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	335.47
LogP ≤ 5	2.64
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 2-(7-tert-butyl-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-3-yl)-N-cyclopentylacetamide?

The IUPAC name of 2-(7-tert-butyl-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-3-yl)-N-cyclopentylacetamide (CID 16868818) is 2-(7-tert-butyl-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-3-yl)-N-cyclopentylacetamide.

What is the SMILES notation for 2-(7-tert-butyl-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-3-yl)-N-cyclopentylacetamide?

The canonical SMILES for 2-(7-tert-butyl-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-3-yl)-N-cyclopentylacetamide is CC(C)(C)c1cc(=O)n2c(n1)SCC2CC(=O)NC1CCCC1.

What is the InChIKey of 2-(7-tert-butyl-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-3-yl)-N-cyclopentylacetamide?

The InChIKey is UGHJHJZPSFXUPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O2S/c1-17(2,3)13-9-15(22)20-12(10-23-16(20)19-13)8-14(21)18-11-6-4-5-7-11/h9,11-12H,4-8,10H2,1-3H3,(H,18,21).

What are the key properties of 2-(7-tert-butyl-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-3-yl)-N-cyclopentylacetamide?

2-(7-tert-butyl-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-3-yl)-N-cyclopentylacetamide has a molecular weight of 335.47 g/mol, XLogP of 2.64, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(7-tert-butyl-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-3-yl)-N-cyclopentylacetamide is sourced from PubChem (CID 16868818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).