8-(3-hydroxypropyl)-8-azaspiro[4.5]decane-7,9-dione

C12H19NO3 — CID 3283840

IUPAC8-(3-hydroxypropyl)-8-azaspiro[4.5]decane-7,9-dione
SMILESO=C1CC2(CCCC2)CC(=O)N1CCCO
InChIInChI=1S/C12H19NO3/c14-7-3-6-13-10(15)8-12(9-11(13)16)4-1-2-5-12/h14H,1-9H2
InChIKeyVMRJAFTYWBIWIH-UHFFFAOYSA-N
MW225.29 g/mol
LogP1.08
Rot. Bonds3

About 8-(3-hydroxypropyl)-8-azaspiro[4.5]decane-7,9-dione

8-(3-hydroxypropyl)-8-azaspiro[4.5]decane-7,9-dione (PubChem CID 3283840) has the molecular formula C12H19NO3 and a molecular weight of 225.29 g/mol. Its IUPAC name is 8-(3-hydroxypropyl)-8-azaspiro[4.5]decane-7,9-dione.

Molecular Properties

Compound Name8-(3-hydroxypropyl)-8-azaspiro[4.5]decane-7,9-dione
PubChem CID3283840
Molecular FormulaC12H19NO3
Molecular Weight225.29 g/mol
Exact Mass225.14
IUPAC Name8-(3-hydroxypropyl)-8-azaspiro[4.5]decane-7,9-dione
SMILESO=C1CC2(CCCC2)CC(=O)N1CCCO
InChIInChI=1S/C12H19NO3/c14-7-3-6-13-10(15)8-12(9-11(13)16)4-1-2-5-12/h14H,1-9H2
InChIKeyVMRJAFTYWBIWIH-UHFFFAOYSA-N
XLogP1.08
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

8-Propyl-8-azaspiro[4.5]decane-7,9-dione
CID 4349275
8-Butyl-8-azaspiro[4.5]decane-7,9-dione
CID 21803305
8-(3,3,3-Trifluoro-2-hydroxypropyl)-8-azaspiro[4.5]decane-7,9-dione
CID 105649117
3-(2,2-Difluoro-3-hydroxypropyl)-3-azaspiro[5.5]undecane-2,4-dione
CID 106172534
8-(3,3-Difluoro-2-hydroxypropyl)-8-azaspiro[4.5]decane-7,9-dione
CID 114094030
8-(2,2-Difluoro-3-hydroxypropyl)-8-azaspiro[4.5]decane-7,9-dione
CID 114153726
8-(3-Methoxypropyl)-8-azaspiro[4.5]decane-7,9-dione
CID 3659327
8-(2-Hydroxyethyl)-8-azaspiro[4.5]decane-7,9-dione
CID 11344868
8-(4-Hydroxybutyl)-8-azaspiro[4.5]decane-7,9-dione
CID 13673319
8-Ethyl-8-azaspiro[4.5]decane-7,9-dione
CID 19814207
3-(2-Hydroxyethyl)-3-azaspiro[5.5]undecane-2,4-dione
CID 20316685
1-(3-Hydroxypropyl)-4-octylpiperidine-2,6-dione
CID 23328918

Frequently Asked Questions

What is the IUPAC name of 8-(3-hydroxypropyl)-8-azaspiro[4.5]decane-7,9-dione?
The IUPAC name of 8-(3-hydroxypropyl)-8-azaspiro[4.5]decane-7,9-dione (CID 3283840) is 8-(3-hydroxypropyl)-8-azaspiro[4.5]decane-7,9-dione.
What is the SMILES notation for 8-(3-hydroxypropyl)-8-azaspiro[4.5]decane-7,9-dione?
The canonical SMILES for 8-(3-hydroxypropyl)-8-azaspiro[4.5]decane-7,9-dione is O=C1CC2(CCCC2)CC(=O)N1CCCO.
What is the InChIKey of 8-(3-hydroxypropyl)-8-azaspiro[4.5]decane-7,9-dione?
The InChIKey is VMRJAFTYWBIWIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO3/c14-7-3-6-13-10(15)8-12(9-11(13)16)4-1-2-5-12/h14H,1-9H2.
What are the key properties of 8-(3-hydroxypropyl)-8-azaspiro[4.5]decane-7,9-dione?
8-(3-hydroxypropyl)-8-azaspiro[4.5]decane-7,9-dione has a molecular weight of 225.29 g/mol, XLogP of 1.08, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(3-hydroxypropyl)-8-azaspiro[4.5]decane-7,9-dione is sourced from PubChem (CID 3283840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).