5-[2-(methanesulfonamido)ethyl]-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]thiophene-2-carboxamide

C14H19N3O3S3 — CID 30600984

About 5-[2-(methanesulfonamido)ethyl]-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]thiophene-2-carboxamide

5-[2-(methanesulfonamido)ethyl]-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]thiophene-2-carboxamide (PubChem CID 30600984) has the molecular formula C14H19N3O3S3 and a molecular weight of 373.53 g/mol. Its IUPAC name is 5-[2-(methanesulfonamido)ethyl]-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]thiophene-2-carboxamide.

Molecular Properties

• Compound Name: 5-[2-(methanesulfonamido)ethyl]-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]thiophene-2-carboxamide
• PubChem CID: 30600984
• Molecular Formula: C14H19N3O3S3
• Molecular Weight: 373.53 g/mol
• Exact Mass: 373.06
• IUPAC Name: 5-[2-(methanesulfonamido)ethyl]-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]thiophene-2-carboxamide
• SMILES: Cc1nc(CCNC(=O)c2ccc(CCNS(C)(=O)=O)s2)cs1
• InChI: InChI=1S/C14H19N3O3S3/c1-10-17-11(9-21-10)5-7-15-14(18)13-4-3-12(22-13)6-8-16-23(2,19)20/h3-4,9,16H,5-8H2,1-2H3,(H,15,18)
• InChIKey: SNQSJCKMFHYJGZ-UHFFFAOYSA-N
• XLogP: 1.58
• TPSA: 88.16 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 6
• Rotatable Bonds: 8
• Heavy Atoms: 23
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	373.53
LogP ≤ 5	1.58
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 5-[2-(methanesulfonamido)ethyl]-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]thiophene-2-carboxamide?

The IUPAC name of 5-[2-(methanesulfonamido)ethyl]-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]thiophene-2-carboxamide (CID 30600984) is 5-[2-(methanesulfonamido)ethyl]-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]thiophene-2-carboxamide.

What is the SMILES notation for 5-[2-(methanesulfonamido)ethyl]-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]thiophene-2-carboxamide?

The canonical SMILES for 5-[2-(methanesulfonamido)ethyl]-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]thiophene-2-carboxamide is Cc1nc(CCNC(=O)c2ccc(CCNS(C)(=O)=O)s2)cs1.

What is the InChIKey of 5-[2-(methanesulfonamido)ethyl]-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]thiophene-2-carboxamide?

The InChIKey is SNQSJCKMFHYJGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O3S3/c1-10-17-11(9-21-10)5-7-15-14(18)13-4-3-12(22-13)6-8-16-23(2,19)20/h3-4,9,16H,5-8H2,1-2H3,(H,15,18).

What are the key properties of 5-[2-(methanesulfonamido)ethyl]-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]thiophene-2-carboxamide?

5-[2-(methanesulfonamido)ethyl]-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]thiophene-2-carboxamide has a molecular weight of 373.53 g/mol, XLogP of 1.58, 8 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[2-(methanesulfonamido)ethyl]-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]thiophene-2-carboxamide is sourced from PubChem (CID 30600984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).