N-[3-[6-chloro-8-[(3-fluoro-2-pyridinyl)methoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]phenyl]acetamide

C22H18ClFN4O2 — CID 121379899

About N-[3-[6-chloro-8-[(3-fluoro-2-pyridinyl)methoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]phenyl]acetamide

N-[3-[6-chloro-8-[(3-fluoro-2-pyridinyl)methoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]phenyl]acetamide (PubChem CID 121379899) has the molecular formula C22H18ClFN4O2 and a molecular weight of 424.86 g/mol. Its IUPAC name is N-[3-[6-chloro-8-[(3-fluoro-2-pyridinyl)methoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]phenyl]acetamide.

Molecular Properties

• Compound Name: N-[3-[6-chloro-8-[(3-fluoro-2-pyridinyl)methoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]phenyl]acetamide
• PubChem CID: 121379899
• Molecular Formula: C22H18ClFN4O2
• Molecular Weight: 424.86 g/mol
• Exact Mass: 424.11
• IUPAC Name: N-[3-[6-chloro-8-[(3-fluoro-2-pyridinyl)methoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]phenyl]acetamide
• SMILES: CC(=O)Nc1cccc(-c2c(C)nc3c(OCc4ncccc4F)cc(Cl)cn23)c1
• InChI: InChI=1S/C22H18ClFN4O2/c1-13-21(15-5-3-6-17(9-15)27-14(2)29)28-11-16(23)10-20(22(28)26-13)30-12-19-18(24)7-4-8-25-19/h3-11H,12H2,1-2H3,(H,27,29)
• InChIKey: SDURGTMRELBPHA-UHFFFAOYSA-N
• XLogP: 5.03
• TPSA: 68.52 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 5
• Heavy Atoms: 30
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	424.86
LogP ≤ 5	5.03
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of N-[3-[6-chloro-8-[(3-fluoro-2-pyridinyl)methoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]phenyl]acetamide?

The IUPAC name of N-[3-[6-chloro-8-[(3-fluoro-2-pyridinyl)methoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]phenyl]acetamide (CID 121379899) is N-[3-[6-chloro-8-[(3-fluoro-2-pyridinyl)methoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]phenyl]acetamide.

What is the SMILES notation for N-[3-[6-chloro-8-[(3-fluoro-2-pyridinyl)methoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]phenyl]acetamide?

The canonical SMILES for N-[3-[6-chloro-8-[(3-fluoro-2-pyridinyl)methoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]phenyl]acetamide is CC(=O)Nc1cccc(-c2c(C)nc3c(OCc4ncccc4F)cc(Cl)cn23)c1.

What is the InChIKey of N-[3-[6-chloro-8-[(3-fluoro-2-pyridinyl)methoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]phenyl]acetamide?

The InChIKey is SDURGTMRELBPHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18ClFN4O2/c1-13-21(15-5-3-6-17(9-15)27-14(2)29)28-11-16(23)10-20(22(28)26-13)30-12-19-18(24)7-4-8-25-19/h3-11H,12H2,1-2H3,(H,27,29).

What are the key properties of N-[3-[6-chloro-8-[(3-fluoro-2-pyridinyl)methoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]phenyl]acetamide?

N-[3-[6-chloro-8-[(3-fluoro-2-pyridinyl)methoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]phenyl]acetamide has a molecular weight of 424.86 g/mol, XLogP of 5.03, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for N-[3-[6-chloro-8-[(3-fluoro-2-pyridinyl)methoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]phenyl]acetamide is sourced from PubChem (CID 121379899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).