6-(2,2-diethyloxan-4-yl)-4,6-diazaspiro[2.4]heptan-7-one

C14H24N2O2 — CID 83260104

IUPAC6-(2,2-diethyloxan-4-yl)-4,6-diazaspiro[2.4]heptan-7-one
SMILESCCC1(CC)CC(N2CNC3(CC3)C2=O)CCO1
InChIInChI=1S/C14H24N2O2/c1-3-13(4-2)9-11(5-8-18-13)16-10-15-14(6-7-14)12(16)17/h11,15H,3-10H2,1-2H3
InChIKeyGXHYKGUEZHCKRD-UHFFFAOYSA-N
MW252.36 g/mol
LogP1.65
Rot. Bonds3

About 6-(2,2-diethyloxan-4-yl)-4,6-diazaspiro[2.4]heptan-7-one

6-(2,2-diethyloxan-4-yl)-4,6-diazaspiro[2.4]heptan-7-one (PubChem CID 83260104) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is 6-(2,2-diethyloxan-4-yl)-4,6-diazaspiro[2.4]heptan-7-one.

Molecular Properties

Compound Name6-(2,2-diethyloxan-4-yl)-4,6-diazaspiro[2.4]heptan-7-one
PubChem CID83260104
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC Name6-(2,2-diethyloxan-4-yl)-4,6-diazaspiro[2.4]heptan-7-one
SMILESCCC1(CC)CC(N2CNC3(CC3)C2=O)CCO1
InChIInChI=1S/C14H24N2O2/c1-3-13(4-2)9-11(5-8-18-13)16-10-15-14(6-7-14)12(16)17/h11,15H,3-10H2,1-2H3
InChIKeyGXHYKGUEZHCKRD-UHFFFAOYSA-N
XLogP1.65
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,2-diethyloxan-4-yl)-1,3-diazinane-2,4-dione
CID 83039447
6-(3,3-dimethylcyclopentyl)-4,6-diazaspiro[2.4]heptan-7-one
CID 114552420
1-(2,2-diethyloxan-4-yl)-3-methylpiperazine-2,5-dione
CID 83040533
1-(2,2-diethyloxan-4-yl)piperazin-2-one
CID 83040073
1-(2,2-diethyloxan-4-yl)piperidine-2,4-dione
CID 83028865
3-(3,3-dimethylcyclopentyl)-1,3-diazaspiro[4.4]nonan-4-one
CID 114552438
6-(1-ethylpiperidin-3-yl)-4,6-diazaspiro[2.4]heptan-7-one
CID 83245860
3-(2,2-diethyloxan-4-yl)-2-methyl-5-propylimidazolidin-4-one
CID 83260537
1-(2,2-diethyloxan-4-yl)piperidin-2-imine
CID 83029021
3-(2,2-diethyloxan-4-yl)-2-methyl-5-(2-methylpropyl)imidazolidin-4-one
CID 83269868
3-cyclopropyl-5-ethyl-5-methylimidazolidin-4-one
CID 83242641
3-(3,5-dimethylcyclohexyl)-1,3-diazaspiro[4.4]nonan-4-one
CID 83258739

Frequently Asked Questions

What is the IUPAC name of 6-(2,2-diethyloxan-4-yl)-4,6-diazaspiro[2.4]heptan-7-one?
The IUPAC name of 6-(2,2-diethyloxan-4-yl)-4,6-diazaspiro[2.4]heptan-7-one (CID 83260104) is 6-(2,2-diethyloxan-4-yl)-4,6-diazaspiro[2.4]heptan-7-one.
What is the SMILES notation for 6-(2,2-diethyloxan-4-yl)-4,6-diazaspiro[2.4]heptan-7-one?
The canonical SMILES for 6-(2,2-diethyloxan-4-yl)-4,6-diazaspiro[2.4]heptan-7-one is CCC1(CC)CC(N2CNC3(CC3)C2=O)CCO1.
What is the InChIKey of 6-(2,2-diethyloxan-4-yl)-4,6-diazaspiro[2.4]heptan-7-one?
The InChIKey is GXHYKGUEZHCKRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-3-13(4-2)9-11(5-8-18-13)16-10-15-14(6-7-14)12(16)17/h11,15H,3-10H2,1-2H3.
What are the key properties of 6-(2,2-diethyloxan-4-yl)-4,6-diazaspiro[2.4]heptan-7-one?
6-(2,2-diethyloxan-4-yl)-4,6-diazaspiro[2.4]heptan-7-one has a molecular weight of 252.36 g/mol, XLogP of 1.65, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,2-diethyloxan-4-yl)-4,6-diazaspiro[2.4]heptan-7-one is sourced from PubChem (CID 83260104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).