N-[5-(5-methylthiophen-2-yl)sulfonyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl]acetamide

C13H15N3O3S3 — CID 90525408

About N-[5-(5-methylthiophen-2-yl)sulfonyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl]acetamide

N-[5-(5-methylthiophen-2-yl)sulfonyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl]acetamide (PubChem CID 90525408) has the molecular formula C13H15N3O3S3 and a molecular weight of 357.48 g/mol. Its IUPAC name is N-[5-(5-methylthiophen-2-yl)sulfonyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl]acetamide.

Molecular Properties

• Compound Name: N-[5-(5-methylthiophen-2-yl)sulfonyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl]acetamide
• PubChem CID: 90525408
• Molecular Formula: C13H15N3O3S3
• Molecular Weight: 357.48 g/mol
• Exact Mass: 357.03
• IUPAC Name: N-[5-(5-methylthiophen-2-yl)sulfonyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl]acetamide
• SMILES: CC(=O)Nc1nc2c(s1)CN(S(=O)(=O)c1ccc(C)s1)CC2
• InChI: InChI=1S/C13H15N3O3S3/c1-8-3-4-12(20-8)22(18,19)16-6-5-10-11(7-16)21-13(15-10)14-9(2)17/h3-4H,5-7H2,1-2H3,(H,14,15,17)
• InChIKey: FWYJPSVYWCBSHK-UHFFFAOYSA-N
• XLogP: 2.22
• TPSA: 79.37 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 3
• Heavy Atoms: 22
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	357.48
LogP ≤ 5	2.22
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of N-[5-(5-methylthiophen-2-yl)sulfonyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl]acetamide?

The IUPAC name of N-[5-(5-methylthiophen-2-yl)sulfonyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl]acetamide (CID 90525408) is N-[5-(5-methylthiophen-2-yl)sulfonyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl]acetamide.

What is the SMILES notation for N-[5-(5-methylthiophen-2-yl)sulfonyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl]acetamide?

The canonical SMILES for N-[5-(5-methylthiophen-2-yl)sulfonyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl]acetamide is CC(=O)Nc1nc2c(s1)CN(S(=O)(=O)c1ccc(C)s1)CC2.

What is the InChIKey of N-[5-(5-methylthiophen-2-yl)sulfonyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl]acetamide?

The InChIKey is FWYJPSVYWCBSHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O3S3/c1-8-3-4-12(20-8)22(18,19)16-6-5-10-11(7-16)21-13(15-10)14-9(2)17/h3-4H,5-7H2,1-2H3,(H,14,15,17).

What are the key properties of N-[5-(5-methylthiophen-2-yl)sulfonyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl]acetamide?

N-[5-(5-methylthiophen-2-yl)sulfonyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl]acetamide has a molecular weight of 357.48 g/mol, XLogP of 2.22, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for N-[5-(5-methylthiophen-2-yl)sulfonyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl]acetamide is sourced from PubChem (CID 90525408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).