3-cyclohexyl-3-azaspiro[5.5]undecane-2,4-dione

C16H25NO2 — CID 125489474

IUPAC3-cyclohexyl-3-azaspiro[5.5]undecane-2,4-dione
SMILESO=C1CC2(CCCCC2)CC(=O)N1C1CCCCC1
InChIInChI=1S/C16H25NO2/c18-14-11-16(9-5-2-6-10-16)12-15(19)17(14)13-7-3-1-4-8-13/h13H,1-12H2
InChIKeyFNNGTZSGHAEJID-UHFFFAOYSA-N
MW263.38 g/mol
LogP3.42
Rot. Bonds1

About 3-cyclohexyl-3-azaspiro[5.5]undecane-2,4-dione

3-cyclohexyl-3-azaspiro[5.5]undecane-2,4-dione (PubChem CID 125489474) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is 3-cyclohexyl-3-azaspiro[5.5]undecane-2,4-dione.

Molecular Properties

Compound Name3-cyclohexyl-3-azaspiro[5.5]undecane-2,4-dione
PubChem CID125489474
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC Name3-cyclohexyl-3-azaspiro[5.5]undecane-2,4-dione
SMILESO=C1CC2(CCCCC2)CC(=O)N1C1CCCCC1
InChIInChI=1S/C16H25NO2/c18-14-11-16(9-5-2-6-10-16)12-15(19)17(14)13-7-3-1-4-8-13/h13H,1-12H2
InChIKeyFNNGTZSGHAEJID-UHFFFAOYSA-N
XLogP3.42
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

8-cyclopentyl-6,8-diazaspiro[3.6]decane-7,9-dione
CID 81167524
8-(2-aminocyclohexyl)-8-azaspiro[4.5]decane-7,9-dione
CID 61349994
3-(2-aminocyclopentyl)-3-azaspiro[5.5]undecane-2,4-dione
CID 63252503
3-[2-(hydroxymethyl)cyclohexyl]-3-azaspiro[5.5]undecane-2,4-dione
CID 106364743
8-[1-(2-aminoethyl)piperidin-4-yl]-8-azaspiro[4.5]decane-7,9-dione
CID 63630601
8-cyclobutyl-6,8-diazaspiro[3.6]decane-7,9-dione
CID 116658471
1-cycloundecylpiperidine-2,6-dione
CID 166752718
3-cyclobutyl-1,3-diazaspiro[5.5]undecane-2,4-dione
CID 116658437
8-cyclobutyl-6,8-diazaspiro[4.5]decane-7,9-dione
CID 116658436
2-(4-oxocyclohexyl)-2-azaspiro[4.6]undecane-1,3-dione
CID 79672322
1,3-dicyclohexyl-1,3-diazepane-2,4,7-trione
CID 101192207
3-ethyl-3-azaspiro[5.5]undecane-2,4-dione
CID 19814204

Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-3-azaspiro[5.5]undecane-2,4-dione?
The IUPAC name of 3-cyclohexyl-3-azaspiro[5.5]undecane-2,4-dione (CID 125489474) is 3-cyclohexyl-3-azaspiro[5.5]undecane-2,4-dione.
What is the SMILES notation for 3-cyclohexyl-3-azaspiro[5.5]undecane-2,4-dione?
The canonical SMILES for 3-cyclohexyl-3-azaspiro[5.5]undecane-2,4-dione is O=C1CC2(CCCCC2)CC(=O)N1C1CCCCC1.
What is the InChIKey of 3-cyclohexyl-3-azaspiro[5.5]undecane-2,4-dione?
The InChIKey is FNNGTZSGHAEJID-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c18-14-11-16(9-5-2-6-10-16)12-15(19)17(14)13-7-3-1-4-8-13/h13H,1-12H2.
What are the key properties of 3-cyclohexyl-3-azaspiro[5.5]undecane-2,4-dione?
3-cyclohexyl-3-azaspiro[5.5]undecane-2,4-dione has a molecular weight of 263.38 g/mol, XLogP of 3.42, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-3-azaspiro[5.5]undecane-2,4-dione is sourced from PubChem (CID 125489474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).