3-chloro-6-ethoxy-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]pyridine-2-carboxamide

C22H19ClN4O3 — CID 56530800

About 3-chloro-6-ethoxy-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]pyridine-2-carboxamide

3-chloro-6-ethoxy-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]pyridine-2-carboxamide (PubChem CID 56530800) has the molecular formula C22H19ClN4O3 and a molecular weight of 422.87 g/mol. Its IUPAC name is 3-chloro-6-ethoxy-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]pyridine-2-carboxamide.

Molecular Properties

• Compound Name: 3-chloro-6-ethoxy-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]pyridine-2-carboxamide
• PubChem CID: 56530800
• Molecular Formula: C22H19ClN4O3
• Molecular Weight: 422.87 g/mol
• Exact Mass: 422.11
• IUPAC Name: 3-chloro-6-ethoxy-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]pyridine-2-carboxamide
• SMILES: CCOc1ccc(Cl)c(C(=O)Nc2cccc(OCc3cn4ccccc4n3)c2)n1
• InChI: InChI=1S/C22H19ClN4O3/c1-2-29-20-10-9-18(23)21(26-20)22(28)25-15-6-5-7-17(12-15)30-14-16-13-27-11-4-3-8-19(27)24-16/h3-13H,2,14H2,1H3,(H,25,28)
• InChIKey: JGEZMPLSSDZBJF-UHFFFAOYSA-N
• XLogP: 4.61
• TPSA: 77.75 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 7
• Heavy Atoms: 30
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	422.87
LogP ≤ 5	4.61
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 3-chloro-6-ethoxy-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]pyridine-2-carboxamide?

The IUPAC name of 3-chloro-6-ethoxy-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]pyridine-2-carboxamide (CID 56530800) is 3-chloro-6-ethoxy-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]pyridine-2-carboxamide.

What is the SMILES notation for 3-chloro-6-ethoxy-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]pyridine-2-carboxamide?

The canonical SMILES for 3-chloro-6-ethoxy-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]pyridine-2-carboxamide is CCOc1ccc(Cl)c(C(=O)Nc2cccc(OCc3cn4ccccc4n3)c2)n1.

What is the InChIKey of 3-chloro-6-ethoxy-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]pyridine-2-carboxamide?

The InChIKey is JGEZMPLSSDZBJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19ClN4O3/c1-2-29-20-10-9-18(23)21(26-20)22(28)25-15-6-5-7-17(12-15)30-14-16-13-27-11-4-3-8-19(27)24-16/h3-13H,2,14H2,1H3,(H,25,28).

What are the key properties of 3-chloro-6-ethoxy-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]pyridine-2-carboxamide?

3-chloro-6-ethoxy-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]pyridine-2-carboxamide has a molecular weight of 422.87 g/mol, XLogP of 4.61, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 3-chloro-6-ethoxy-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]pyridine-2-carboxamide is sourced from PubChem (CID 56530800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).