(3-methylfuran-2-yl)-[8-(2-pyridin-3-yloxyethyl)-5-oxa-2-azaspiro[3.4]octan-2-yl]methanone

C19H22N2O4 — CID 131669328

About (3-methylfuran-2-yl)-[8-(2-pyridin-3-yloxyethyl)-5-oxa-2-azaspiro[3.4]octan-2-yl]methanone

(3-methylfuran-2-yl)-[8-(2-pyridin-3-yloxyethyl)-5-oxa-2-azaspiro[3.4]octan-2-yl]methanone (PubChem CID 131669328) has the molecular formula C19H22N2O4 and a molecular weight of 342.39 g/mol. Its IUPAC name is (3-methylfuran-2-yl)-[8-(2-pyridin-3-yloxyethyl)-5-oxa-2-azaspiro[3.4]octan-2-yl]methanone.

Molecular Properties

• Compound Name: (3-methylfuran-2-yl)-[8-(2-pyridin-3-yloxyethyl)-5-oxa-2-azaspiro[3.4]octan-2-yl]methanone
• PubChem CID: 131669328
• Molecular Formula: C19H22N2O4
• Molecular Weight: 342.39 g/mol
• Exact Mass: 342.16
• IUPAC Name: (3-methylfuran-2-yl)-[8-(2-pyridin-3-yloxyethyl)-5-oxa-2-azaspiro[3.4]octan-2-yl]methanone
• SMILES: Cc1ccoc1C(=O)N1CC2(C1)OCCC2CCOc1cccnc1
• InChI: InChI=1S/C19H22N2O4/c1-14-4-8-24-17(14)18(22)21-12-19(13-21)15(6-10-25-19)5-9-23-16-3-2-7-20-11-16/h2-4,7-8,11,15H,5-6,9-10,12-13H2,1H3
• InChIKey: LKSREPIHSWBXHP-UHFFFAOYSA-N
• XLogP: 2.68
• TPSA: 64.80 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 5
• Heavy Atoms: 25
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	342.39
LogP ≤ 5	2.68
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of (3-methylfuran-2-yl)-[8-(2-pyridin-3-yloxyethyl)-5-oxa-2-azaspiro[3.4]octan-2-yl]methanone?

The IUPAC name of (3-methylfuran-2-yl)-[8-(2-pyridin-3-yloxyethyl)-5-oxa-2-azaspiro[3.4]octan-2-yl]methanone (CID 131669328) is (3-methylfuran-2-yl)-[8-(2-pyridin-3-yloxyethyl)-5-oxa-2-azaspiro[3.4]octan-2-yl]methanone.

What is the SMILES notation for (3-methylfuran-2-yl)-[8-(2-pyridin-3-yloxyethyl)-5-oxa-2-azaspiro[3.4]octan-2-yl]methanone?

The canonical SMILES for (3-methylfuran-2-yl)-[8-(2-pyridin-3-yloxyethyl)-5-oxa-2-azaspiro[3.4]octan-2-yl]methanone is Cc1ccoc1C(=O)N1CC2(C1)OCCC2CCOc1cccnc1.

What is the InChIKey of (3-methylfuran-2-yl)-[8-(2-pyridin-3-yloxyethyl)-5-oxa-2-azaspiro[3.4]octan-2-yl]methanone?

The InChIKey is LKSREPIHSWBXHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O4/c1-14-4-8-24-17(14)18(22)21-12-19(13-21)15(6-10-25-19)5-9-23-16-3-2-7-20-11-16/h2-4,7-8,11,15H,5-6,9-10,12-13H2,1H3.

What are the key properties of (3-methylfuran-2-yl)-[8-(2-pyridin-3-yloxyethyl)-5-oxa-2-azaspiro[3.4]octan-2-yl]methanone?

(3-methylfuran-2-yl)-[8-(2-pyridin-3-yloxyethyl)-5-oxa-2-azaspiro[3.4]octan-2-yl]methanone has a molecular weight of 342.39 g/mol, XLogP of 2.68, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for (3-methylfuran-2-yl)-[8-(2-pyridin-3-yloxyethyl)-5-oxa-2-azaspiro[3.4]octan-2-yl]methanone is sourced from PubChem (CID 131669328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).