6-[2-(2-methoxyethoxy)ethyl]-4,6-diazaspiro[2.4]heptan-7-one

C10H18N2O3 — CID 83256016

IUPAC6-[2-(2-methoxyethoxy)ethyl]-4,6-diazaspiro[2.4]heptan-7-one
SMILESCOCCOCCN1CNC2(CC2)C1=O
InChIInChI=1S/C10H18N2O3/c1-14-6-7-15-5-4-12-8-11-10(2-3-10)9(12)13/h11H,2-8H2,1H3
InChIKeyQAPSWKUXNAJWCS-UHFFFAOYSA-N
MW214.26 g/mol
LogP-0.43
Rot. Bonds6

About 6-[2-(2-methoxyethoxy)ethyl]-4,6-diazaspiro[2.4]heptan-7-one

6-[2-(2-methoxyethoxy)ethyl]-4,6-diazaspiro[2.4]heptan-7-one (PubChem CID 83256016) has the molecular formula C10H18N2O3 and a molecular weight of 214.26 g/mol. Its IUPAC name is 6-[2-(2-methoxyethoxy)ethyl]-4,6-diazaspiro[2.4]heptan-7-one.

Molecular Properties

Compound Name6-[2-(2-methoxyethoxy)ethyl]-4,6-diazaspiro[2.4]heptan-7-one
PubChem CID83256016
Molecular FormulaC10H18N2O3
Molecular Weight214.26 g/mol
Exact Mass214.13
IUPAC Name6-[2-(2-methoxyethoxy)ethyl]-4,6-diazaspiro[2.4]heptan-7-one
SMILESCOCCOCCN1CNC2(CC2)C1=O
InChIInChI=1S/C10H18N2O3/c1-14-6-7-15-5-4-12-8-11-10(2-3-10)9(12)13/h11H,2-8H2,1H3
InChIKeyQAPSWKUXNAJWCS-UHFFFAOYSA-N
XLogP-0.43
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 5-0.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-[2-[2-(dimethylamino)ethoxy]ethyl]-1,3-diazaspiro[4.4]nonan-4-one
CID 114128162
1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-3,3-dimethylpiperazin-2-one
CID 104566176
6-(2-cyclopentyloxyethyl)-4,6-diazaspiro[2.4]heptan-7-one
CID 83257915
1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]imidazolidine-2,4-dione
CID 113427526
6-(3-methylsulfanylpropyl)-4,6-diazaspiro[2.4]heptan-7-one
CID 83256993
3-[2-(2-methoxyethoxy)ethyl]-5-methylimidazolidin-4-one
CID 83256580
3-decyl-1,3-diazaspiro[4.4]nonan-4-one
CID 83270884
1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-3,3-dimethylpiperazine-2,6-dione
CID 104566190
1-[2-(2-methoxyethoxy)ethyl]-5-methyl-1,3-diazinane-2,4-dione
CID 77073110
5-ethyl-5-methyl-3-[2-(2,2,2-trifluoroethoxy)ethyl]imidazolidin-4-one
CID 83263391
4-bromo-1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-3,3-dimethylpiperazine-2,5-dione
CID 87941958
6-[(1-methylazetidin-3-yl)methyl]-4,6-diazaspiro[2.4]heptan-7-one
CID 130908995

Frequently Asked Questions

What is the IUPAC name of 6-[2-(2-methoxyethoxy)ethyl]-4,6-diazaspiro[2.4]heptan-7-one?
The IUPAC name of 6-[2-(2-methoxyethoxy)ethyl]-4,6-diazaspiro[2.4]heptan-7-one (CID 83256016) is 6-[2-(2-methoxyethoxy)ethyl]-4,6-diazaspiro[2.4]heptan-7-one.
What is the SMILES notation for 6-[2-(2-methoxyethoxy)ethyl]-4,6-diazaspiro[2.4]heptan-7-one?
The canonical SMILES for 6-[2-(2-methoxyethoxy)ethyl]-4,6-diazaspiro[2.4]heptan-7-one is COCCOCCN1CNC2(CC2)C1=O.
What is the InChIKey of 6-[2-(2-methoxyethoxy)ethyl]-4,6-diazaspiro[2.4]heptan-7-one?
The InChIKey is QAPSWKUXNAJWCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O3/c1-14-6-7-15-5-4-12-8-11-10(2-3-10)9(12)13/h11H,2-8H2,1H3.
What are the key properties of 6-[2-(2-methoxyethoxy)ethyl]-4,6-diazaspiro[2.4]heptan-7-one?
6-[2-(2-methoxyethoxy)ethyl]-4,6-diazaspiro[2.4]heptan-7-one has a molecular weight of 214.26 g/mol, XLogP of -0.43, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(2-methoxyethoxy)ethyl]-4,6-diazaspiro[2.4]heptan-7-one is sourced from PubChem (CID 83256016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).