5-(7-ethoxy-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl)-3-fluoro-6-methylpyridin-2-amine

C18H21FN4O3S — CID 170616359

About 5-(7-ethoxy-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl)-3-fluoro-6-methylpyridin-2-amine

5-(7-ethoxy-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl)-3-fluoro-6-methylpyridin-2-amine (PubChem CID 170616359) has the molecular formula C18H21FN4O3S and a molecular weight of 392.46 g/mol. Its IUPAC name is 5-(7-ethoxy-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl)-3-fluoro-6-methylpyridin-2-amine.

Molecular Properties

• Compound Name: 5-(7-ethoxy-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl)-3-fluoro-6-methylpyridin-2-amine
• PubChem CID: 170616359
• Molecular Formula: C18H21FN4O3S
• Molecular Weight: 392.46 g/mol
• Exact Mass: 392.13
• IUPAC Name: 5-(7-ethoxy-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl)-3-fluoro-6-methylpyridin-2-amine
• SMILES: CCOc1cc2ncc(-c3cc(F)c(N)nc3C)n2cc1S(=O)(=O)C(C)C
• InChI: InChI=1S/C18H21FN4O3S/c1-5-26-15-7-17-21-8-14(12-6-13(19)18(20)22-11(12)4)23(17)9-16(15)27(24,25)10(2)3/h6-10H,5H2,1-4H3,(H2,20,22)
• InChIKey: KBOZUMPKJRBHDK-UHFFFAOYSA-N
• XLogP: 3.01
• TPSA: 99.58 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 7
• Rotatable Bonds: 5
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	392.46
LogP ≤ 5	3.01
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of 5-(7-ethoxy-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl)-3-fluoro-6-methylpyridin-2-amine?

The IUPAC name of 5-(7-ethoxy-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl)-3-fluoro-6-methylpyridin-2-amine (CID 170616359) is 5-(7-ethoxy-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl)-3-fluoro-6-methylpyridin-2-amine.

What is the SMILES notation for 5-(7-ethoxy-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl)-3-fluoro-6-methylpyridin-2-amine?

The canonical SMILES for 5-(7-ethoxy-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl)-3-fluoro-6-methylpyridin-2-amine is CCOc1cc2ncc(-c3cc(F)c(N)nc3C)n2cc1S(=O)(=O)C(C)C.

What is the InChIKey of 5-(7-ethoxy-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl)-3-fluoro-6-methylpyridin-2-amine?

The InChIKey is KBOZUMPKJRBHDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21FN4O3S/c1-5-26-15-7-17-21-8-14(12-6-13(19)18(20)22-11(12)4)23(17)9-16(15)27(24,25)10(2)3/h6-10H,5H2,1-4H3,(H2,20,22).

What are the key properties of 5-(7-ethoxy-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl)-3-fluoro-6-methylpyridin-2-amine?

5-(7-ethoxy-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl)-3-fluoro-6-methylpyridin-2-amine has a molecular weight of 392.46 g/mol, XLogP of 3.01, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 5-(7-ethoxy-6-propan-2-ylsulfonylimidazo[1,2-a]pyridin-3-yl)-3-fluoro-6-methylpyridin-2-amine is sourced from PubChem (CID 170616359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).