4-hydroxy-1-azaspiro[4.5]dec-3-en-2-one

C9H13NO2 — CID 89405315

IUPAC4-hydroxy-1-azaspiro[4.5]dec-3-en-2-one
SMILESO=C1C=C(O)C2(CCCCC2)N1
InChIInChI=1S/C9H13NO2/c11-7-6-8(12)10-9(7)4-2-1-3-5-9/h6,11H,1-5H2,(H,10,12)
InChIKeyDKZCFWPHEIPPJB-UHFFFAOYSA-N
MW167.21 g/mol
LogP1.26
Rot. Bonds

About 4-hydroxy-1-azaspiro[4.5]dec-3-en-2-one

4-hydroxy-1-azaspiro[4.5]dec-3-en-2-one (PubChem CID 89405315) has the molecular formula C9H13NO2 and a molecular weight of 167.21 g/mol. Its IUPAC name is 4-hydroxy-1-azaspiro[4.5]dec-3-en-2-one.

Molecular Properties

Compound Name4-hydroxy-1-azaspiro[4.5]dec-3-en-2-one
PubChem CID89405315
Molecular FormulaC9H13NO2
Molecular Weight167.21 g/mol
Exact Mass167.09
IUPAC Name4-hydroxy-1-azaspiro[4.5]dec-3-en-2-one
SMILESO=C1C=C(O)C2(CCCCC2)N1
InChIInChI=1S/C9H13NO2/c11-7-6-8(12)10-9(7)4-2-1-3-5-9/h6,11H,1-5H2,(H,10,12)
InChIKeyDKZCFWPHEIPPJB-UHFFFAOYSA-N
XLogP1.26
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.21
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

7-hydroxy-4-azaspiro[2.4]hept-6-en-5-one
CID 89405313
4-hydroxy-9-oxa-1-azaspiro[4.5]dec-3-en-2-one
CID 89405299
3-(2-hydroxyethyl)-1,3-diazaspiro[4.7]dodecane-2,4-dione
CID 43509728
3-(2-aminoethyl)-1,3-diazaspiro[4.5]decane-2,4-dione
CID 18071047
3-(2-hydroxyethyl)-1,3-diazaspiro[4.6]undecane-2,4-dione
CID 12866
4-amino-1,3-diazaspiro[4.7]dodec-3-en-2-one
CID 79960446
7-[(1-hydroxycyclohexyl)methyl]-5,7-diazaspiro[3.4]octane-6,8-dione
CID 110921685
3-(3-hydroxypropyl)-1,3-diazaspiro[4.7]dodecane-2,4-dione
CID 43509729
3-(3-aminopropyl)-1,3-diazaspiro[4.5]decane-2,4-dione
CID 18071372
3-(2-oxopropyl)-1,3-diazaspiro[4.5]decane-2,4-dione
CID 7610156
(6Z)-6-hydroxyimino-12-azadispiro[4.1.47.25]tridecan-13-one
CID 6516263
spiro[1,4-dihydroquinoxaline-3,1'-cyclohexane]-2-one
CID 12886753

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-1-azaspiro[4.5]dec-3-en-2-one?
The IUPAC name of 4-hydroxy-1-azaspiro[4.5]dec-3-en-2-one (CID 89405315) is 4-hydroxy-1-azaspiro[4.5]dec-3-en-2-one.
What is the SMILES notation for 4-hydroxy-1-azaspiro[4.5]dec-3-en-2-one?
The canonical SMILES for 4-hydroxy-1-azaspiro[4.5]dec-3-en-2-one is O=C1C=C(O)C2(CCCCC2)N1.
What is the InChIKey of 4-hydroxy-1-azaspiro[4.5]dec-3-en-2-one?
The InChIKey is DKZCFWPHEIPPJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO2/c11-7-6-8(12)10-9(7)4-2-1-3-5-9/h6,11H,1-5H2,(H,10,12).
What are the key properties of 4-hydroxy-1-azaspiro[4.5]dec-3-en-2-one?
4-hydroxy-1-azaspiro[4.5]dec-3-en-2-one has a molecular weight of 167.21 g/mol, XLogP of 1.26, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-1-azaspiro[4.5]dec-3-en-2-one is sourced from PubChem (CID 89405315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).