(2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl) acetate

C9H14N2O4 — CID 141400367

IUPAC(2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl) acetate
SMILESCC(=O)ON1CC2(CCNCC2)OC1=O
InChIInChI=1S/C9H14N2O4/c1-7(12)15-11-6-9(14-8(11)13)2-4-10-5-3-9/h10H,2-6H2,1H3
InChIKeyRVLYVAGDKLLBOQ-UHFFFAOYSA-N
MW214.22 g/mol
LogP0.04
Rot. Bonds1

About (2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl) acetate

(2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl) acetate (PubChem CID 141400367) has the molecular formula C9H14N2O4 and a molecular weight of 214.22 g/mol. Its IUPAC name is (2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl) acetate.

Molecular Properties

Compound Name(2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl) acetate
PubChem CID141400367
Molecular FormulaC9H14N2O4
Molecular Weight214.22 g/mol
Exact Mass214.10
IUPAC Name(2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl) acetate
SMILESCC(=O)ON1CC2(CCNCC2)OC1=O
InChIInChI=1S/C9H14N2O4/c1-7(12)15-11-6-9(14-8(11)13)2-4-10-5-3-9/h10H,2-6H2,1H3
InChIKeyRVLYVAGDKLLBOQ-UHFFFAOYSA-N
XLogP0.04
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.22
LogP ≤ 50.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[8-[(4-cyanophenyl)methoxy]-2-oxo-1-oxa-3-azaspiro[4.5]decan-3-yl] acetate
CID 70236913
3-(4-methylphenyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one
CID 66764577
3-(2,2,2-trifluoroethyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one
CID 131262021
3-(2-hydroxyethyl)-1-oxa-3,9-diazaspiro[5.5]undecan-2-one
CID 105467641
4-methyl-1-oxa-4,9-diazaspiro[5.5]undecan-3-one;hydrochloride
CID 75531160
methoxy-[4-(2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl)cyclohexyl]phosphinic acid
CID 156749346
3-cyclopropyl-1-oxa-3,9-diazaspiro[4.6]undecan-2-one
CID 84781302
3-cyclobutyl-1-oxa-3,9-diazaspiro[4.6]undecan-2-one
CID 84789780
ethyl 1-oxa-4,9-diazaspiro[5.5]undecane-4-carboxylate
CID 97449218
N-[(1S)-1-(2-methoxyphenyl)ethyl]-N-methyl-2-(2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl)acetamide
CID 97279194
piperazin-1-yl acetate
CID 54492305
4-(2,2-dimethylpropyl)-1-oxa-4,9-diazaspiro[5.5]undecan-3-one
CID 115067433

Frequently Asked Questions

What is the IUPAC name of (2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl) acetate?
The IUPAC name of (2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl) acetate (CID 141400367) is (2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl) acetate.
What is the SMILES notation for (2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl) acetate?
The canonical SMILES for (2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl) acetate is CC(=O)ON1CC2(CCNCC2)OC1=O.
What is the InChIKey of (2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl) acetate?
The InChIKey is RVLYVAGDKLLBOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O4/c1-7(12)15-11-6-9(14-8(11)13)2-4-10-5-3-9/h10H,2-6H2,1H3.
What are the key properties of (2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl) acetate?
(2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl) acetate has a molecular weight of 214.22 g/mol, XLogP of 0.04, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-3-yl) acetate is sourced from PubChem (CID 141400367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).