N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(2-thiophen-2-yl-1,3-thiazol-4-yl)acetamide

C23H18N4O2S2 — CID 56582659

About N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(2-thiophen-2-yl-1,3-thiazol-4-yl)acetamide

N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(2-thiophen-2-yl-1,3-thiazol-4-yl)acetamide (PubChem CID 56582659) has the molecular formula C23H18N4O2S2 and a molecular weight of 446.56 g/mol. Its IUPAC name is N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(2-thiophen-2-yl-1,3-thiazol-4-yl)acetamide.

Molecular Properties

• Compound Name: N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(2-thiophen-2-yl-1,3-thiazol-4-yl)acetamide
• PubChem CID: 56582659
• Molecular Formula: C23H18N4O2S2
• Molecular Weight: 446.56 g/mol
• Exact Mass: 446.09
• IUPAC Name: N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(2-thiophen-2-yl-1,3-thiazol-4-yl)acetamide
• SMILES: O=C(Cc1csc(-c2cccs2)n1)Nc1cccc(OCc2cn3ccccc3n2)c1
• InChI: InChI=1S/C23H18N4O2S2/c28-22(12-17-15-31-23(26-17)20-7-4-10-30-20)25-16-5-3-6-19(11-16)29-14-18-13-27-9-2-1-8-21(27)24-18/h1-11,13,15H,12,14H2,(H,25,28)
• InChIKey: JBCJOECXOOLHIS-UHFFFAOYSA-N
• XLogP: 5.28
• TPSA: 68.52 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 7
• Rotatable Bonds: 7
• Heavy Atoms: 31
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	446.56
LogP ≤ 5	5.28
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(2-thiophen-2-yl-1,3-thiazol-4-yl)acetamide?

The IUPAC name of N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(2-thiophen-2-yl-1,3-thiazol-4-yl)acetamide (CID 56582659) is N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(2-thiophen-2-yl-1,3-thiazol-4-yl)acetamide.

What is the SMILES notation for N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(2-thiophen-2-yl-1,3-thiazol-4-yl)acetamide?

The canonical SMILES for N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(2-thiophen-2-yl-1,3-thiazol-4-yl)acetamide is O=C(Cc1csc(-c2cccs2)n1)Nc1cccc(OCc2cn3ccccc3n2)c1.

What is the InChIKey of N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(2-thiophen-2-yl-1,3-thiazol-4-yl)acetamide?

The InChIKey is JBCJOECXOOLHIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18N4O2S2/c28-22(12-17-15-31-23(26-17)20-7-4-10-30-20)25-16-5-3-6-19(11-16)29-14-18-13-27-9-2-1-8-21(27)24-18/h1-11,13,15H,12,14H2,(H,25,28).

What are the key properties of N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(2-thiophen-2-yl-1,3-thiazol-4-yl)acetamide?

N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(2-thiophen-2-yl-1,3-thiazol-4-yl)acetamide has a molecular weight of 446.56 g/mol, XLogP of 5.28, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(2-thiophen-2-yl-1,3-thiazol-4-yl)acetamide is sourced from PubChem (CID 56582659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).