8-ethyl-9-(7-oxabicyclo[2.2.1]heptan-2-yl)-6,9-diazaspiro[4.5]decane-7,10-dione

C16H24N2O3 — CID 80725501

IUPAC8-ethyl-9-(7-oxabicyclo[2.2.1]heptan-2-yl)-6,9-diazaspiro[4.5]decane-7,10-dione
SMILESCCC1C(=O)NC2(CCCC2)C(=O)N1C1CC2CCC1O2
InChIInChI=1S/C16H24N2O3/c1-2-11-14(19)17-16(7-3-4-8-16)15(20)18(11)12-9-10-5-6-13(12)21-10/h10-13H,2-9H2,1H3,(H,17,19)
InChIKeyCUZNICHRCZDZEC-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.36
Rot. Bonds2

About 8-ethyl-9-(7-oxabicyclo[2.2.1]heptan-2-yl)-6,9-diazaspiro[4.5]decane-7,10-dione

8-ethyl-9-(7-oxabicyclo[2.2.1]heptan-2-yl)-6,9-diazaspiro[4.5]decane-7,10-dione (PubChem CID 80725501) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is 8-ethyl-9-(7-oxabicyclo[2.2.1]heptan-2-yl)-6,9-diazaspiro[4.5]decane-7,10-dione.

Molecular Properties

Compound Name8-ethyl-9-(7-oxabicyclo[2.2.1]heptan-2-yl)-6,9-diazaspiro[4.5]decane-7,10-dione
PubChem CID80725501
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC Name8-ethyl-9-(7-oxabicyclo[2.2.1]heptan-2-yl)-6,9-diazaspiro[4.5]decane-7,10-dione
SMILESCCC1C(=O)NC2(CCCC2)C(=O)N1C1CC2CCC1O2
InChIInChI=1S/C16H24N2O3/c1-2-11-14(19)17-16(7-3-4-8-16)15(20)18(11)12-9-10-5-6-13(12)21-10/h10-13H,2-9H2,1H3,(H,17,19)
InChIKeyCUZNICHRCZDZEC-UHFFFAOYSA-N
XLogP1.36
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 8-ethyl-9-(7-oxabicyclo[2.2.1]heptan-2-yl)-6,9-diazaspiro[4.5]decane-7,10-dione with MolForge

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Related Compounds

2-ethyl-3-(7-oxabicyclo[2.2.1]heptan-2-yl)-1,3-diazaspiro[4.4]nonan-4-one
CID 83270692
9-(2-bicyclo[2.2.1]heptanyl)-8-ethyl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64972715
3-tert-butyl-6-ethyl-1-(7-oxabicyclo[2.2.1]heptan-2-yl)piperazine-2,5-dione
CID 80725478
8,9-diethyl-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64887606
8-ethyl-9-(1-methylcyclopentyl)-6,9-diazaspiro[4.5]decane-7,10-dione
CID 64973613
3-ethyl-1-(7-oxabicyclo[2.2.1]heptan-2-yl)-6-propan-2-ylpiperazine-2,5-dione
CID 80731819
3,3-diethyl-1-(7-oxabicyclo[2.2.1]heptan-2-yl)piperazine-2,5-dione
CID 80733238
4-butyl-3-ethyl-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 64886290
8-ethyl-9-(2-methylprop-2-enyl)-6,9-diazaspiro[4.5]decane-7,10-dione
CID 114619330
3-methyl-1-(7-oxabicyclo[2.2.1]heptan-2-yl)-6-propan-2-ylpiperazine-2,5-dione
CID 80732818
2-cyclopentyl-3-(7-oxabicyclo[2.2.1]heptan-2-yl)-5-propylimidazolidin-4-one
CID 83267451
3-ethyl-4-phenyl-1,4-diazaspiro[5.5]undecane-2,5-dione
CID 64958744

Frequently Asked Questions

What is the IUPAC name of 8-ethyl-9-(7-oxabicyclo[2.2.1]heptan-2-yl)-6,9-diazaspiro[4.5]decane-7,10-dione?
The IUPAC name of 8-ethyl-9-(7-oxabicyclo[2.2.1]heptan-2-yl)-6,9-diazaspiro[4.5]decane-7,10-dione (CID 80725501) is 8-ethyl-9-(7-oxabicyclo[2.2.1]heptan-2-yl)-6,9-diazaspiro[4.5]decane-7,10-dione.
What is the SMILES notation for 8-ethyl-9-(7-oxabicyclo[2.2.1]heptan-2-yl)-6,9-diazaspiro[4.5]decane-7,10-dione?
The canonical SMILES for 8-ethyl-9-(7-oxabicyclo[2.2.1]heptan-2-yl)-6,9-diazaspiro[4.5]decane-7,10-dione is CCC1C(=O)NC2(CCCC2)C(=O)N1C1CC2CCC1O2.
What is the InChIKey of 8-ethyl-9-(7-oxabicyclo[2.2.1]heptan-2-yl)-6,9-diazaspiro[4.5]decane-7,10-dione?
The InChIKey is CUZNICHRCZDZEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-2-11-14(19)17-16(7-3-4-8-16)15(20)18(11)12-9-10-5-6-13(12)21-10/h10-13H,2-9H2,1H3,(H,17,19).
What are the key properties of 8-ethyl-9-(7-oxabicyclo[2.2.1]heptan-2-yl)-6,9-diazaspiro[4.5]decane-7,10-dione?
8-ethyl-9-(7-oxabicyclo[2.2.1]heptan-2-yl)-6,9-diazaspiro[4.5]decane-7,10-dione has a molecular weight of 292.38 g/mol, XLogP of 1.36, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-ethyl-9-(7-oxabicyclo[2.2.1]heptan-2-yl)-6,9-diazaspiro[4.5]decane-7,10-dione is sourced from PubChem (CID 80725501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).