2-azaspiro[4.4]nonan-8-one;ethane

C10H19NO — CID 171093172

IUPAC2-azaspiro[4.4]nonan-8-one;ethane
SMILESCC.O=C1CCC2(CCNC2)C1
InChIInChI=1S/C8H13NO.C2H6/c10-7-1-2-8(5-7)3-4-9-6-8;1-2/h9H,1-6H2;1-2H3
InChIKeySTHODZSEVVWENK-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.75
Rot. Bonds

About 2-azaspiro[4.4]nonan-8-one;ethane

2-azaspiro[4.4]nonan-8-one;ethane (PubChem CID 171093172) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 2-azaspiro[4.4]nonan-8-one;ethane.

Molecular Properties

Compound Name2-azaspiro[4.4]nonan-8-one;ethane
PubChem CID171093172
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name2-azaspiro[4.4]nonan-8-one;ethane
SMILESCC.O=C1CCC2(CCNC2)C1
InChIInChI=1S/C8H13NO.C2H6/c10-7-1-2-8(5-7)3-4-9-6-8;1-2/h9H,1-6H2;1-2H3
InChIKeySTHODZSEVVWENK-UHFFFAOYSA-N
XLogP1.75
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-azaspiro[4.4]nonan-8-one;ethane?
The IUPAC name of 2-azaspiro[4.4]nonan-8-one;ethane (CID 171093172) is 2-azaspiro[4.4]nonan-8-one;ethane.
What is the SMILES notation for 2-azaspiro[4.4]nonan-8-one;ethane?
The canonical SMILES for 2-azaspiro[4.4]nonan-8-one;ethane is CC.O=C1CCC2(CCNC2)C1.
What is the InChIKey of 2-azaspiro[4.4]nonan-8-one;ethane?
The InChIKey is STHODZSEVVWENK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO.C2H6/c10-7-1-2-8(5-7)3-4-9-6-8;1-2/h9H,1-6H2;1-2H3.
What are the key properties of 2-azaspiro[4.4]nonan-8-one;ethane?
2-azaspiro[4.4]nonan-8-one;ethane has a molecular weight of 169.27 g/mol, XLogP of 1.75, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-azaspiro[4.4]nonan-8-one;ethane is sourced from PubChem (CID 171093172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).