8-(7-methylimidazo[1,2-a]pyridine-2-carbonyl)-3-(morpholin-4-ylmethyl)-2-oxa-8-azaspiro[4.5]decan-1-one

C22H28N4O4 — CID 172667416

About 8-(7-methylimidazo[1,2-a]pyridine-2-carbonyl)-3-(morpholin-4-ylmethyl)-2-oxa-8-azaspiro[4.5]decan-1-one

8-(7-methylimidazo[1,2-a]pyridine-2-carbonyl)-3-(morpholin-4-ylmethyl)-2-oxa-8-azaspiro[4.5]decan-1-one (PubChem CID 172667416) has the molecular formula C22H28N4O4 and a molecular weight of 412.49 g/mol. Its IUPAC name is 8-(7-methylimidazo[1,2-a]pyridine-2-carbonyl)-3-(morpholin-4-ylmethyl)-2-oxa-8-azaspiro[4.5]decan-1-one.

Molecular Properties

• Compound Name: 8-(7-methylimidazo[1,2-a]pyridine-2-carbonyl)-3-(morpholin-4-ylmethyl)-2-oxa-8-azaspiro[4.5]decan-1-one
• PubChem CID: 172667416
• Molecular Formula: C22H28N4O4
• Molecular Weight: 412.49 g/mol
• Exact Mass: 412.21
• IUPAC Name: 8-(7-methylimidazo[1,2-a]pyridine-2-carbonyl)-3-(morpholin-4-ylmethyl)-2-oxa-8-azaspiro[4.5]decan-1-one
• SMILES: Cc1ccn2cc(C(=O)N3CCC4(CC3)CC(CN3CCOCC3)OC4=O)nc2c1
• InChI: InChI=1S/C22H28N4O4/c1-16-2-5-26-15-18(23-19(26)12-16)20(27)25-6-3-22(4-7-25)13-17(30-21(22)28)14-24-8-10-29-11-9-24/h2,5,12,15,17H,3-4,6-11,13-14H2,1H3
• InChIKey: LXSVBCPSXGSQTB-UHFFFAOYSA-N
• XLogP: 1.51
• TPSA: 76.38 Ų
• H-Bond Acceptors: 7
• Rotatable Bonds: 3
• Heavy Atoms: 30
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	412.49
LogP ≤ 5	1.51
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of 8-(7-methylimidazo[1,2-a]pyridine-2-carbonyl)-3-(morpholin-4-ylmethyl)-2-oxa-8-azaspiro[4.5]decan-1-one?

The IUPAC name of 8-(7-methylimidazo[1,2-a]pyridine-2-carbonyl)-3-(morpholin-4-ylmethyl)-2-oxa-8-azaspiro[4.5]decan-1-one (CID 172667416) is 8-(7-methylimidazo[1,2-a]pyridine-2-carbonyl)-3-(morpholin-4-ylmethyl)-2-oxa-8-azaspiro[4.5]decan-1-one.

What is the SMILES notation for 8-(7-methylimidazo[1,2-a]pyridine-2-carbonyl)-3-(morpholin-4-ylmethyl)-2-oxa-8-azaspiro[4.5]decan-1-one?

The canonical SMILES for 8-(7-methylimidazo[1,2-a]pyridine-2-carbonyl)-3-(morpholin-4-ylmethyl)-2-oxa-8-azaspiro[4.5]decan-1-one is Cc1ccn2cc(C(=O)N3CCC4(CC3)CC(CN3CCOCC3)OC4=O)nc2c1.

What is the InChIKey of 8-(7-methylimidazo[1,2-a]pyridine-2-carbonyl)-3-(morpholin-4-ylmethyl)-2-oxa-8-azaspiro[4.5]decan-1-one?

The InChIKey is LXSVBCPSXGSQTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N4O4/c1-16-2-5-26-15-18(23-19(26)12-16)20(27)25-6-3-22(4-7-25)13-17(30-21(22)28)14-24-8-10-29-11-9-24/h2,5,12,15,17H,3-4,6-11,13-14H2,1H3.

What are the key properties of 8-(7-methylimidazo[1,2-a]pyridine-2-carbonyl)-3-(morpholin-4-ylmethyl)-2-oxa-8-azaspiro[4.5]decan-1-one?

8-(7-methylimidazo[1,2-a]pyridine-2-carbonyl)-3-(morpholin-4-ylmethyl)-2-oxa-8-azaspiro[4.5]decan-1-one has a molecular weight of 412.49 g/mol, XLogP of 1.51, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 8-(7-methylimidazo[1,2-a]pyridine-2-carbonyl)-3-(morpholin-4-ylmethyl)-2-oxa-8-azaspiro[4.5]decan-1-one is sourced from PubChem (CID 172667416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).