5-methyl-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)thiophene-2-carboxamide

C19H14N2OS2 — CID 16549476

About 5-methyl-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)thiophene-2-carboxamide

5-methyl-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)thiophene-2-carboxamide (PubChem CID 16549476) has the molecular formula C19H14N2OS2 and a molecular weight of 350.47 g/mol. Its IUPAC name is 5-methyl-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)thiophene-2-carboxamide.

Molecular Properties

• Compound Name: 5-methyl-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)thiophene-2-carboxamide
• PubChem CID: 16549476
• Molecular Formula: C19H14N2OS2
• Molecular Weight: 350.47 g/mol
• Exact Mass: 350.05
• IUPAC Name: 5-methyl-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)thiophene-2-carboxamide
• SMILES: Cc1ccc(C(=O)Nc2nc(-c3ccc4ccccc4c3)cs2)s1
• InChI: InChI=1S/C19H14N2OS2/c1-12-6-9-17(24-12)18(22)21-19-20-16(11-23-19)15-8-7-13-4-2-3-5-14(13)10-15/h2-11H,1H3,(H,20,21,22)
• InChIKey: MNJLLYZBKRYWSG-UHFFFAOYSA-N
• XLogP: 5.59
• TPSA: 41.99 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 4
• Rotatable Bonds: 3
• Heavy Atoms: 24
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	350.47
LogP ≤ 5	5.59
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

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

The IUPAC name of 5-methyl-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)thiophene-2-carboxamide (CID 16549476) is 5-methyl-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)thiophene-2-carboxamide.

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

The canonical SMILES for 5-methyl-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)thiophene-2-carboxamide is Cc1ccc(C(=O)Nc2nc(-c3ccc4ccccc4c3)cs2)s1.

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

The InChIKey is MNJLLYZBKRYWSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N2OS2/c1-12-6-9-17(24-12)18(22)21-19-20-16(11-23-19)15-8-7-13-4-2-3-5-14(13)10-15/h2-11H,1H3,(H,20,21,22).

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

5-methyl-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)thiophene-2-carboxamide has a molecular weight of 350.47 g/mol, XLogP of 5.59, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 5-methyl-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)thiophene-2-carboxamide is sourced from PubChem (CID 16549476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).