1-hydroxy-1-azaspiro[3.5]nonane-2,7-dione

C8H11NO3 — CID 141129975

IUPAC1-hydroxy-1-azaspiro[3.5]nonane-2,7-dione
SMILESO=C1CCC2(CC1)CC(=O)N2O
InChIInChI=1S/C8H11NO3/c10-6-1-3-8(4-2-6)5-7(11)9(8)12/h12H,1-5H2
InChIKeyFWUVDMUEIURBDE-UHFFFAOYSA-N
MW169.18 g/mol
LogP0.49
Rot. Bonds

About 1-hydroxy-1-azaspiro[3.5]nonane-2,7-dione

1-hydroxy-1-azaspiro[3.5]nonane-2,7-dione (PubChem CID 141129975) has the molecular formula C8H11NO3 and a molecular weight of 169.18 g/mol. Its IUPAC name is 1-hydroxy-1-azaspiro[3.5]nonane-2,7-dione.

Molecular Properties

Compound Name1-hydroxy-1-azaspiro[3.5]nonane-2,7-dione
PubChem CID141129975
Molecular FormulaC8H11NO3
Molecular Weight169.18 g/mol
Exact Mass169.07
IUPAC Name1-hydroxy-1-azaspiro[3.5]nonane-2,7-dione
SMILESO=C1CCC2(CC1)CC(=O)N2O
InChIInChI=1S/C8H11NO3/c10-6-1-3-8(4-2-6)5-7(11)9(8)12/h12H,1-5H2
InChIKeyFWUVDMUEIURBDE-UHFFFAOYSA-N
XLogP0.49
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.18
LogP ≤ 50.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-1-azaspiro[3.5]nonane-2,7-dione?
The IUPAC name of 1-hydroxy-1-azaspiro[3.5]nonane-2,7-dione (CID 141129975) is 1-hydroxy-1-azaspiro[3.5]nonane-2,7-dione.
What is the SMILES notation for 1-hydroxy-1-azaspiro[3.5]nonane-2,7-dione?
The canonical SMILES for 1-hydroxy-1-azaspiro[3.5]nonane-2,7-dione is O=C1CCC2(CC1)CC(=O)N2O.
What is the InChIKey of 1-hydroxy-1-azaspiro[3.5]nonane-2,7-dione?
The InChIKey is FWUVDMUEIURBDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO3/c10-6-1-3-8(4-2-6)5-7(11)9(8)12/h12H,1-5H2.
What are the key properties of 1-hydroxy-1-azaspiro[3.5]nonane-2,7-dione?
1-hydroxy-1-azaspiro[3.5]nonane-2,7-dione has a molecular weight of 169.18 g/mol, XLogP of 0.49, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-1-azaspiro[3.5]nonane-2,7-dione is sourced from PubChem (CID 141129975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).