methyl 8-hydroxy-1-oxa-4-azaspiro[4.5]decane-3-carboxylate

C10H17NO4 — CID 165447867

IUPACmethyl 8-hydroxy-1-oxa-4-azaspiro[4.5]decane-3-carboxylate
SMILESCOC(=O)C1COC2(CCC(O)CC2)N1
InChIInChI=1S/C10H17NO4/c1-14-9(13)8-6-15-10(11-8)4-2-7(12)3-5-10/h7-8,11-12H,2-6H2,1H3
InChIKeyAHPWWIWAUANPMC-UHFFFAOYSA-N
MW215.25 g/mol
LogP-0.22
Rot. Bonds1

About methyl 8-hydroxy-1-oxa-4-azaspiro[4.5]decane-3-carboxylate

methyl 8-hydroxy-1-oxa-4-azaspiro[4.5]decane-3-carboxylate (PubChem CID 165447867) has the molecular formula C10H17NO4 and a molecular weight of 215.25 g/mol. Its IUPAC name is methyl 8-hydroxy-1-oxa-4-azaspiro[4.5]decane-3-carboxylate.

Molecular Properties

Compound Namemethyl 8-hydroxy-1-oxa-4-azaspiro[4.5]decane-3-carboxylate
PubChem CID165447867
Molecular FormulaC10H17NO4
Molecular Weight215.25 g/mol
Exact Mass215.12
IUPAC Namemethyl 8-hydroxy-1-oxa-4-azaspiro[4.5]decane-3-carboxylate
SMILESCOC(=O)C1COC2(CCC(O)CC2)N1
InChIInChI=1S/C10H17NO4/c1-14-9(13)8-6-15-10(11-8)4-2-7(12)3-5-10/h7-8,11-12H,2-6H2,1H3
InChIKeyAHPWWIWAUANPMC-UHFFFAOYSA-N
XLogP-0.22
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.25
LogP ≤ 5-0.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 8-methyl-1-oxa-4-azaspiro[4.4]nonane-3-carboxylate
CID 165444556
methyl 10,12-dioxa-7-azadispiro[3.1.46.24]dodecane-8-carboxylate
CID 165447869
ethyl 1-oxa-4-azaspiro[4.4]nonane-3-carboxylate
CID 131538145
methyl 2,9-dioxa-6-azaspiro[4.5]decane-7-carboxylate
CID 105453383
methyl 1-azaspiro[3.4]octane-2-carboxylate
CID 167715027
methyl 5,5-dimethylpyrrolidine-2-carboxylate
CID 75088958
methyl (2S,4S)-4-hydroxypyrrolidine-2-carboxylate
CID 7021050
methyl (2R,4R)-4-hydroxypyrrolidine-2-carboxylate;hydrochloride
CID 12764090
methyl (2S)-aziridine-2-carboxylate
CID 10329257
methyl (2S,5R)-5-hydroxyoxane-2-carboxylate
CID 67431822
methyl 9-methyl-1,5-dioxaspiro[5.5]undecane-3-carboxylate
CID 10466322
methyl (8R)-1,4-dioxa-7-azaspiro[4.4]nonane-8-carboxylate
CID 122607276

Frequently Asked Questions

What is the IUPAC name of methyl 8-hydroxy-1-oxa-4-azaspiro[4.5]decane-3-carboxylate?
The IUPAC name of methyl 8-hydroxy-1-oxa-4-azaspiro[4.5]decane-3-carboxylate (CID 165447867) is methyl 8-hydroxy-1-oxa-4-azaspiro[4.5]decane-3-carboxylate.
What is the SMILES notation for methyl 8-hydroxy-1-oxa-4-azaspiro[4.5]decane-3-carboxylate?
The canonical SMILES for methyl 8-hydroxy-1-oxa-4-azaspiro[4.5]decane-3-carboxylate is COC(=O)C1COC2(CCC(O)CC2)N1.
What is the InChIKey of methyl 8-hydroxy-1-oxa-4-azaspiro[4.5]decane-3-carboxylate?
The InChIKey is AHPWWIWAUANPMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO4/c1-14-9(13)8-6-15-10(11-8)4-2-7(12)3-5-10/h7-8,11-12H,2-6H2,1H3.
What are the key properties of methyl 8-hydroxy-1-oxa-4-azaspiro[4.5]decane-3-carboxylate?
methyl 8-hydroxy-1-oxa-4-azaspiro[4.5]decane-3-carboxylate has a molecular weight of 215.25 g/mol, XLogP of -0.22, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 8-hydroxy-1-oxa-4-azaspiro[4.5]decane-3-carboxylate is sourced from PubChem (CID 165447867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).