5,5-dimethyl-1-(1-oxaspiro[4.5]decan-2-ylmethyl)imidazolidine-2,4-dione

C15H24N2O3 — CID 102901153

IUPAC5,5-dimethyl-1-(1-oxaspiro[4.5]decan-2-ylmethyl)imidazolidine-2,4-dione
SMILESCC1(C)C(=O)NC(=O)N1CC1CCC2(CCCCC2)O1
InChIInChI=1S/C15H24N2O3/c1-14(2)12(18)16-13(19)17(14)10-11-6-9-15(20-11)7-4-3-5-8-15/h11H,3-10H2,1-2H3,(H,16,18,19)
InChIKeyIIDIUMIRVVPICH-UHFFFAOYSA-N
MW280.37 g/mol
LogP2.20
Rot. Bonds2

About 5,5-dimethyl-1-(1-oxaspiro[4.5]decan-2-ylmethyl)imidazolidine-2,4-dione

5,5-dimethyl-1-(1-oxaspiro[4.5]decan-2-ylmethyl)imidazolidine-2,4-dione (PubChem CID 102901153) has the molecular formula C15H24N2O3 and a molecular weight of 280.37 g/mol. Its IUPAC name is 5,5-dimethyl-1-(1-oxaspiro[4.5]decan-2-ylmethyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name5,5-dimethyl-1-(1-oxaspiro[4.5]decan-2-ylmethyl)imidazolidine-2,4-dione
PubChem CID102901153
Molecular FormulaC15H24N2O3
Molecular Weight280.37 g/mol
Exact Mass280.18
IUPAC Name5,5-dimethyl-1-(1-oxaspiro[4.5]decan-2-ylmethyl)imidazolidine-2,4-dione
SMILESCC1(C)C(=O)NC(=O)N1CC1CCC2(CCCCC2)O1
InChIInChI=1S/C15H24N2O3/c1-14(2)12(18)16-13(19)17(14)10-11-6-9-15(20-11)7-4-3-5-8-15/h11H,3-10H2,1-2H3,(H,16,18,19)
InChIKeyIIDIUMIRVVPICH-UHFFFAOYSA-N
XLogP2.20
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5,5-dimethyl-1-(1-oxaspiro[4.5]decan-2-ylmethyl)imidazolidine-2,4-dione?
The IUPAC name of 5,5-dimethyl-1-(1-oxaspiro[4.5]decan-2-ylmethyl)imidazolidine-2,4-dione (CID 102901153) is 5,5-dimethyl-1-(1-oxaspiro[4.5]decan-2-ylmethyl)imidazolidine-2,4-dione.
What is the SMILES notation for 5,5-dimethyl-1-(1-oxaspiro[4.5]decan-2-ylmethyl)imidazolidine-2,4-dione?
The canonical SMILES for 5,5-dimethyl-1-(1-oxaspiro[4.5]decan-2-ylmethyl)imidazolidine-2,4-dione is CC1(C)C(=O)NC(=O)N1CC1CCC2(CCCCC2)O1.
What is the InChIKey of 5,5-dimethyl-1-(1-oxaspiro[4.5]decan-2-ylmethyl)imidazolidine-2,4-dione?
The InChIKey is IIDIUMIRVVPICH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3/c1-14(2)12(18)16-13(19)17(14)10-11-6-9-15(20-11)7-4-3-5-8-15/h11H,3-10H2,1-2H3,(H,16,18,19).
What are the key properties of 5,5-dimethyl-1-(1-oxaspiro[4.5]decan-2-ylmethyl)imidazolidine-2,4-dione?
5,5-dimethyl-1-(1-oxaspiro[4.5]decan-2-ylmethyl)imidazolidine-2,4-dione has a molecular weight of 280.37 g/mol, XLogP of 2.20, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-dimethyl-1-(1-oxaspiro[4.5]decan-2-ylmethyl)imidazolidine-2,4-dione is sourced from PubChem (CID 102901153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).