1-hydroxy-1-azaspiro[4.4]nonane-2,4-dione

C8H11NO3 — CID 141096346

IUPAC1-hydroxy-1-azaspiro[4.4]nonane-2,4-dione
SMILESO=C1CC(=O)C2(CCCC2)N1O
InChIInChI=1S/C8H11NO3/c10-6-5-7(11)9(12)8(6)3-1-2-4-8/h12H,1-5H2
InChIKeyZBWKVRNRDMGBDP-UHFFFAOYSA-N
MW169.18 g/mol
LogP0.49
Rot. Bonds

About 1-hydroxy-1-azaspiro[4.4]nonane-2,4-dione

1-hydroxy-1-azaspiro[4.4]nonane-2,4-dione (PubChem CID 141096346) has the molecular formula C8H11NO3 and a molecular weight of 169.18 g/mol. Its IUPAC name is 1-hydroxy-1-azaspiro[4.4]nonane-2,4-dione.

Molecular Properties

Compound Name1-hydroxy-1-azaspiro[4.4]nonane-2,4-dione
PubChem CID141096346
Molecular FormulaC8H11NO3
Molecular Weight169.18 g/mol
Exact Mass169.07
IUPAC Name1-hydroxy-1-azaspiro[4.4]nonane-2,4-dione
SMILESO=C1CC(=O)C2(CCCC2)N1O
InChIInChI=1S/C8H11NO3/c10-6-5-7(11)9(12)8(6)3-1-2-4-8/h12H,1-5H2
InChIKeyZBWKVRNRDMGBDP-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': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}

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Related Compounds

1-methyl-1-azaspiro[4.4]nonane-2,4-dione
CID 14507935
1-methyl-1-azaspiro[4.6]undecan-4-one
CID 18468802
1-hydroxy-2-phenyl-1,3-diazaspiro[4.5]dec-2-en-4-one
CID 15587684
2-hydroxy-2-azaspiro[4.11]hexadecane-1,3-dione
CID 10563768
5-methyl-6,6-dioxo-6λ6-thia-5-azaspiro[3.4]octan-8-one
CID 99989118
spiro[4.5]decane-6,8,10-trione
CID 141056738
spiro[13.14]octacosan-28-one
CID 12738452
dispiro[5.1.58.36]hexadecane-14,16-dione
CID 163588226
2-(2,4-dioxo-3-azaspiro[5.5]undecan-3-yl)acetic acid
CID 43804746
1-hydroxy-1-azaspiro[3.5]nonane-2,7-dione
CID 141129975
1-hydroxy-2,2-dimethyl-4-propan-2-yl-1,4-diazaspiro[5.6]dodecan-5-one
CID 20681102
1-[[1-(hydroxymethyl)cyclopentyl]methyl]-3-methylpyrrolidine-2,5-dione
CID 115363188

Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-1-azaspiro[4.4]nonane-2,4-dione?
The IUPAC name of 1-hydroxy-1-azaspiro[4.4]nonane-2,4-dione (CID 141096346) is 1-hydroxy-1-azaspiro[4.4]nonane-2,4-dione.
What is the SMILES notation for 1-hydroxy-1-azaspiro[4.4]nonane-2,4-dione?
The canonical SMILES for 1-hydroxy-1-azaspiro[4.4]nonane-2,4-dione is O=C1CC(=O)C2(CCCC2)N1O.
What is the InChIKey of 1-hydroxy-1-azaspiro[4.4]nonane-2,4-dione?
The InChIKey is ZBWKVRNRDMGBDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO3/c10-6-5-7(11)9(12)8(6)3-1-2-4-8/h12H,1-5H2.
What are the key properties of 1-hydroxy-1-azaspiro[4.4]nonane-2,4-dione?
1-hydroxy-1-azaspiro[4.4]nonane-2,4-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[4.4]nonane-2,4-dione is sourced from PubChem (CID 141096346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).