3-hydroxy-7,12-dioxa-3-azaspiro[5.6]dodecane-8,11-dione

C9H13NO5 — CID 154395592

IUPAC3-hydroxy-7,12-dioxa-3-azaspiro[5.6]dodecane-8,11-dione
SMILESO=C1CCC(=O)OC2(CCN(O)CC2)O1
InChIInChI=1S/C9H13NO5/c11-7-1-2-8(12)15-9(14-7)3-5-10(13)6-4-9/h13H,1-6H2
InChIKeyHIEAJWMRKDXEFE-UHFFFAOYSA-N
MW215.20 g/mol
LogP0.05
Rot. Bonds

About 3-hydroxy-7,12-dioxa-3-azaspiro[5.6]dodecane-8,11-dione

3-hydroxy-7,12-dioxa-3-azaspiro[5.6]dodecane-8,11-dione (PubChem CID 154395592) has the molecular formula C9H13NO5 and a molecular weight of 215.20 g/mol. Its IUPAC name is 3-hydroxy-7,12-dioxa-3-azaspiro[5.6]dodecane-8,11-dione.

Molecular Properties

Compound Name3-hydroxy-7,12-dioxa-3-azaspiro[5.6]dodecane-8,11-dione
PubChem CID154395592
Molecular FormulaC9H13NO5
Molecular Weight215.20 g/mol
Exact Mass215.08
IUPAC Name3-hydroxy-7,12-dioxa-3-azaspiro[5.6]dodecane-8,11-dione
SMILESO=C1CCC(=O)OC2(CCN(O)CC2)O1
InChIInChI=1S/C9H13NO5/c11-7-1-2-8(12)15-9(14-7)3-5-10(13)6-4-9/h13H,1-6H2
InChIKeyHIEAJWMRKDXEFE-UHFFFAOYSA-N
XLogP0.05
TPSA76.07 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.20
LogP ≤ 50.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

carbon dioxide;deuterium monohydride;1,6-dioxaspiro[4.4]nonane-2,7-dione;oxolane-2,5-dione
CID 161050040
2-hydroxy-2-(2-hydroxy-4,13-dioxo-1,3-dioxacyclotridec-2-yl)-1,3-dioxacyclotridecane-4,13-dione
CID 139914308
6,10-dioxaspiro[4.5]decane-7,9-dione;5,9-dioxaspiro[3.5]nonane-6,8-dione;1,5-dioxaspiro[5.5]undecane-2,4-dione
CID 159322778
(6R)-6-(hydroxymethyl)-6-methyloxan-2-one
CID 129388764
(6S)-6-(hydroxymethyl)-6-methyloxan-2-one
CID 14165937
7-hydroxy-1-oxa-7-azaspiro[3.5]nonane
CID 167142466
1-hydroxy-4,4-dimethylpiperidine
CID 90735582
2-(1-hydroxyethenyl)-2-methyl-1,3-dioxepane-4,7-dione
CID 142771087
tert-butyl 2-oxo-1-oxa-9-azaspiro[5.5]undecane-9-carboxylate
CID 22975821
(3R,6S)-3-ethyl-1,7-dioxaspiro[5.5]undecane-2,8-dione
CID 15402415
9-methyl-1,5-dioxaspiro[5.5]undecane-2,4-dione
CID 143148723
(3S)-1,7-dioxa-2-thiaspiro[2.4]heptan-6-one
CID 176528836

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-7,12-dioxa-3-azaspiro[5.6]dodecane-8,11-dione?
The IUPAC name of 3-hydroxy-7,12-dioxa-3-azaspiro[5.6]dodecane-8,11-dione (CID 154395592) is 3-hydroxy-7,12-dioxa-3-azaspiro[5.6]dodecane-8,11-dione.
What is the SMILES notation for 3-hydroxy-7,12-dioxa-3-azaspiro[5.6]dodecane-8,11-dione?
The canonical SMILES for 3-hydroxy-7,12-dioxa-3-azaspiro[5.6]dodecane-8,11-dione is O=C1CCC(=O)OC2(CCN(O)CC2)O1.
What is the InChIKey of 3-hydroxy-7,12-dioxa-3-azaspiro[5.6]dodecane-8,11-dione?
The InChIKey is HIEAJWMRKDXEFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO5/c11-7-1-2-8(12)15-9(14-7)3-5-10(13)6-4-9/h13H,1-6H2.
What are the key properties of 3-hydroxy-7,12-dioxa-3-azaspiro[5.6]dodecane-8,11-dione?
3-hydroxy-7,12-dioxa-3-azaspiro[5.6]dodecane-8,11-dione has a molecular weight of 215.20 g/mol, XLogP of 0.05, 0 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-7,12-dioxa-3-azaspiro[5.6]dodecane-8,11-dione is sourced from PubChem (CID 154395592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).