3-methoxy-1-[(8R)-8-[(6-methyl-2-pyridinyl)methoxy]-5-oxa-2-azaspiro[3.5]nonan-2-yl]propan-1-one

C18H26N2O4 — CID 124795283

About 3-methoxy-1-[(8R)-8-[(6-methyl-2-pyridinyl)methoxy]-5-oxa-2-azaspiro[3.5]nonan-2-yl]propan-1-one

3-methoxy-1-[(8R)-8-[(6-methyl-2-pyridinyl)methoxy]-5-oxa-2-azaspiro[3.5]nonan-2-yl]propan-1-one (PubChem CID 124795283) has the molecular formula C18H26N2O4 and a molecular weight of 334.42 g/mol. Its IUPAC name is 3-methoxy-1-[(8R)-8-[(6-methyl-2-pyridinyl)methoxy]-5-oxa-2-azaspiro[3.5]nonan-2-yl]propan-1-one.

Molecular Properties

• Compound Name: 3-methoxy-1-[(8R)-8-[(6-methyl-2-pyridinyl)methoxy]-5-oxa-2-azaspiro[3.5]nonan-2-yl]propan-1-one
• PubChem CID: 124795283
• Molecular Formula: C18H26N2O4
• Molecular Weight: 334.42 g/mol
• Exact Mass: 334.19
• IUPAC Name: 3-methoxy-1-[(8R)-8-[(6-methyl-2-pyridinyl)methoxy]-5-oxa-2-azaspiro[3.5]nonan-2-yl]propan-1-one
• SMILES: COCCC(=O)N1CC2(C[C@H](OCc3cccc(C)n3)CCO2)C1
• InChI: InChI=1S/C18H26N2O4/c1-14-4-3-5-15(19-14)11-23-16-6-9-24-18(10-16)12-20(13-18)17(21)7-8-22-2/h3-5,16H,6-13H2,1-2H3/t16-/m1/s1
• InChIKey: QDIRJRGRNSFJTO-MRXNPFEDSA-N
• XLogP: 1.70
• TPSA: 60.89 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 6
• Heavy Atoms: 24
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	334.42
LogP ≤ 5	1.70
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-1-[(8R)-8-[(6-methyl-2-pyridinyl)methoxy]-5-oxa-2-azaspiro[3.5]nonan-2-yl]propan-1-one?

The IUPAC name of 3-methoxy-1-[(8R)-8-[(6-methyl-2-pyridinyl)methoxy]-5-oxa-2-azaspiro[3.5]nonan-2-yl]propan-1-one (CID 124795283) is 3-methoxy-1-[(8R)-8-[(6-methyl-2-pyridinyl)methoxy]-5-oxa-2-azaspiro[3.5]nonan-2-yl]propan-1-one.

What is the SMILES notation for 3-methoxy-1-[(8R)-8-[(6-methyl-2-pyridinyl)methoxy]-5-oxa-2-azaspiro[3.5]nonan-2-yl]propan-1-one?

The canonical SMILES for 3-methoxy-1-[(8R)-8-[(6-methyl-2-pyridinyl)methoxy]-5-oxa-2-azaspiro[3.5]nonan-2-yl]propan-1-one is COCCC(=O)N1CC2(C[C@H](OCc3cccc(C)n3)CCO2)C1.

What is the InChIKey of 3-methoxy-1-[(8R)-8-[(6-methyl-2-pyridinyl)methoxy]-5-oxa-2-azaspiro[3.5]nonan-2-yl]propan-1-one?

The InChIKey is QDIRJRGRNSFJTO-MRXNPFEDSA-N. The full InChI is InChI=1S/C18H26N2O4/c1-14-4-3-5-15(19-14)11-23-16-6-9-24-18(10-16)12-20(13-18)17(21)7-8-22-2/h3-5,16H,6-13H2,1-2H3/t16-/m1/s1.

What are the key properties of 3-methoxy-1-[(8R)-8-[(6-methyl-2-pyridinyl)methoxy]-5-oxa-2-azaspiro[3.5]nonan-2-yl]propan-1-one?

3-methoxy-1-[(8R)-8-[(6-methyl-2-pyridinyl)methoxy]-5-oxa-2-azaspiro[3.5]nonan-2-yl]propan-1-one has a molecular weight of 334.42 g/mol, XLogP of 1.70, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 3-methoxy-1-[(8R)-8-[(6-methyl-2-pyridinyl)methoxy]-5-oxa-2-azaspiro[3.5]nonan-2-yl]propan-1-one is sourced from PubChem (CID 124795283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).