3-amino-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)-6-propylthieno[2,3-b]pyridine-2-carboxamide

C24H20N4OS2 — CID 23830180

About 3-amino-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)-6-propylthieno[2,3-b]pyridine-2-carboxamide

3-amino-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)-6-propylthieno[2,3-b]pyridine-2-carboxamide (PubChem CID 23830180) has the molecular formula C24H20N4OS2 and a molecular weight of 444.59 g/mol. Its IUPAC name is 3-amino-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)-6-propylthieno[2,3-b]pyridine-2-carboxamide.

Molecular Properties

• Compound Name: 3-amino-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)-6-propylthieno[2,3-b]pyridine-2-carboxamide
• PubChem CID: 23830180
• Molecular Formula: C24H20N4OS2
• Molecular Weight: 444.59 g/mol
• Exact Mass: 444.11
• IUPAC Name: 3-amino-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)-6-propylthieno[2,3-b]pyridine-2-carboxamide
• SMILES: CCCc1ccc2c(N)c(C(=O)Nc3nc(-c4ccc5ccccc5c4)cs3)sc2n1
• InChI: InChI=1S/C24H20N4OS2/c1-2-5-17-10-11-18-20(25)21(31-23(18)26-17)22(29)28-24-27-19(13-30-24)16-9-8-14-6-3-4-7-15(14)12-16/h3-4,6-13H,2,5,25H2,1H3,(H,27,28,29)
• InChIKey: ALYOTJYWAIEYMV-UHFFFAOYSA-N
• XLogP: 6.36
• TPSA: 80.90 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 6
• Rotatable Bonds: 5
• Heavy Atoms: 31
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	444.59
LogP ≤ 5	6.36
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)-6-propylthieno[2,3-b]pyridine-2-carboxamide?

The IUPAC name of 3-amino-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)-6-propylthieno[2,3-b]pyridine-2-carboxamide (CID 23830180) is 3-amino-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)-6-propylthieno[2,3-b]pyridine-2-carboxamide.

What is the SMILES notation for 3-amino-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)-6-propylthieno[2,3-b]pyridine-2-carboxamide?

The canonical SMILES for 3-amino-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)-6-propylthieno[2,3-b]pyridine-2-carboxamide is CCCc1ccc2c(N)c(C(=O)Nc3nc(-c4ccc5ccccc5c4)cs3)sc2n1.

What is the InChIKey of 3-amino-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)-6-propylthieno[2,3-b]pyridine-2-carboxamide?

The InChIKey is ALYOTJYWAIEYMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N4OS2/c1-2-5-17-10-11-18-20(25)21(31-23(18)26-17)22(29)28-24-27-19(13-30-24)16-9-8-14-6-3-4-7-15(14)12-16/h3-4,6-13H,2,5,25H2,1H3,(H,27,28,29).

What are the key properties of 3-amino-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)-6-propylthieno[2,3-b]pyridine-2-carboxamide?

3-amino-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)-6-propylthieno[2,3-b]pyridine-2-carboxamide has a molecular weight of 444.59 g/mol, XLogP of 6.36, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 3-amino-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)-6-propylthieno[2,3-b]pyridine-2-carboxamide is sourced from PubChem (CID 23830180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).