1-azaspiro[4.5]decane-2,7-dione

C9H13NO2 — CID 24973668

IUPAC1-azaspiro[4.5]decane-2,7-dione
SMILESO=C1CCCC2(CCC(=O)N2)C1
InChIInChI=1S/C9H13NO2/c11-7-2-1-4-9(6-7)5-3-8(12)10-9/h1-6H2,(H,10,12)
InChIKeyJLUZZGZZCOQCBR-UHFFFAOYSA-N
MW167.21 g/mol
LogP0.78
Rot. Bonds

About 1-azaspiro[4.5]decane-2,7-dione

1-azaspiro[4.5]decane-2,7-dione (PubChem CID 24973668) has the molecular formula C9H13NO2 and a molecular weight of 167.21 g/mol. Its IUPAC name is 1-azaspiro[4.5]decane-2,7-dione.

Molecular Properties

Compound Name1-azaspiro[4.5]decane-2,7-dione
PubChem CID24973668
Molecular FormulaC9H13NO2
Molecular Weight167.21 g/mol
Exact Mass167.09
IUPAC Name1-azaspiro[4.5]decane-2,7-dione
SMILESO=C1CCCC2(CCC(=O)N2)C1
InChIInChI=1S/C9H13NO2/c11-7-2-1-4-9(6-7)5-3-8(12)10-9/h1-6H2,(H,10,12)
InChIKeyJLUZZGZZCOQCBR-UHFFFAOYSA-N
XLogP0.78
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.21
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-azaspiro[4.5]decane-2,7-dione?
The IUPAC name of 1-azaspiro[4.5]decane-2,7-dione (CID 24973668) is 1-azaspiro[4.5]decane-2,7-dione.
What is the SMILES notation for 1-azaspiro[4.5]decane-2,7-dione?
The canonical SMILES for 1-azaspiro[4.5]decane-2,7-dione is O=C1CCCC2(CCC(=O)N2)C1.
What is the InChIKey of 1-azaspiro[4.5]decane-2,7-dione?
The InChIKey is JLUZZGZZCOQCBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO2/c11-7-2-1-4-9(6-7)5-3-8(12)10-9/h1-6H2,(H,10,12).
What are the key properties of 1-azaspiro[4.5]decane-2,7-dione?
1-azaspiro[4.5]decane-2,7-dione has a molecular weight of 167.21 g/mol, XLogP of 0.78, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-azaspiro[4.5]decane-2,7-dione is sourced from PubChem (CID 24973668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).