6-methoxy-1-azaspiro[3.5]nonan-2-one

C9H15NO2 — CID 106874445

IUPAC6-methoxy-1-azaspiro[3.5]nonan-2-one
SMILESCOC1CCCC2(CC(=O)N2)C1
InChIInChI=1S/C9H15NO2/c1-12-7-3-2-4-9(5-7)6-8(11)10-9/h7H,2-6H2,1H3,(H,10,11)
InChIKeyUPTKUSXCAGSWEE-UHFFFAOYSA-N
MW169.22 g/mol
LogP0.83
Rot. Bonds1

About 6-methoxy-1-azaspiro[3.5]nonan-2-one

6-methoxy-1-azaspiro[3.5]nonan-2-one (PubChem CID 106874445) has the molecular formula C9H15NO2 and a molecular weight of 169.22 g/mol. Its IUPAC name is 6-methoxy-1-azaspiro[3.5]nonan-2-one.

Molecular Properties

Compound Name6-methoxy-1-azaspiro[3.5]nonan-2-one
PubChem CID106874445
Molecular FormulaC9H15NO2
Molecular Weight169.22 g/mol
Exact Mass169.11
IUPAC Name6-methoxy-1-azaspiro[3.5]nonan-2-one
SMILESCOC1CCCC2(CC(=O)N2)C1
InChIInChI=1S/C9H15NO2/c1-12-7-3-2-4-9(5-7)6-8(11)10-9/h7H,2-6H2,1H3,(H,10,11)
InChIKeyUPTKUSXCAGSWEE-UHFFFAOYSA-N
XLogP0.83
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.22
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-methoxy-1-azaspiro[3.5]nonan-2-one?
The IUPAC name of 6-methoxy-1-azaspiro[3.5]nonan-2-one (CID 106874445) is 6-methoxy-1-azaspiro[3.5]nonan-2-one.
What is the SMILES notation for 6-methoxy-1-azaspiro[3.5]nonan-2-one?
The canonical SMILES for 6-methoxy-1-azaspiro[3.5]nonan-2-one is COC1CCCC2(CC(=O)N2)C1.
What is the InChIKey of 6-methoxy-1-azaspiro[3.5]nonan-2-one?
The InChIKey is UPTKUSXCAGSWEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO2/c1-12-7-3-2-4-9(5-7)6-8(11)10-9/h7H,2-6H2,1H3,(H,10,11).
What are the key properties of 6-methoxy-1-azaspiro[3.5]nonan-2-one?
6-methoxy-1-azaspiro[3.5]nonan-2-one has a molecular weight of 169.22 g/mol, XLogP of 0.83, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-1-azaspiro[3.5]nonan-2-one is sourced from PubChem (CID 106874445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).