8-tert-butyl-1,3-diazaspiro[4.5]decane-2,4-dione

C12H20N2O2 — CID 2374182

IUPAC8-tert-butyl-1,3-diazaspiro[4.5]decane-2,4-dione
SMILESCC(C)(C)C1CCC2(CC1)NC(=O)NC2=O
InChIInChI=1S/C12H20N2O2/c1-11(2,3)8-4-6-12(7-5-8)9(15)13-10(16)14-12/h8H,4-7H2,1-3H3,(H2,13,14,15,16)
InChIKeyRQUKBTLNDXLLEA-UHFFFAOYSA-N
MW224.30 g/mol
LogP1.80
Rot. Bonds

About 8-tert-butyl-1,3-diazaspiro[4.5]decane-2,4-dione

8-tert-butyl-1,3-diazaspiro[4.5]decane-2,4-dione (PubChem CID 2374182) has the molecular formula C12H20N2O2 and a molecular weight of 224.30 g/mol. Its IUPAC name is 8-tert-butyl-1,3-diazaspiro[4.5]decane-2,4-dione.

Molecular Properties

Compound Name8-tert-butyl-1,3-diazaspiro[4.5]decane-2,4-dione
PubChem CID2374182
Molecular FormulaC12H20N2O2
Molecular Weight224.30 g/mol
Exact Mass224.15
IUPAC Name8-tert-butyl-1,3-diazaspiro[4.5]decane-2,4-dione
SMILESCC(C)(C)C1CCC2(CC1)NC(=O)NC2=O
InChIInChI=1S/C12H20N2O2/c1-11(2,3)8-4-6-12(7-5-8)9(15)13-10(16)14-12/h8H,4-7H2,1-3H3,(H2,13,14,15,16)
InChIKeyRQUKBTLNDXLLEA-UHFFFAOYSA-N
XLogP1.80
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 8-tert-butyl-1,3-diazaspiro[4.5]decane-2,4-dione?
The IUPAC name of 8-tert-butyl-1,3-diazaspiro[4.5]decane-2,4-dione (CID 2374182) is 8-tert-butyl-1,3-diazaspiro[4.5]decane-2,4-dione.
What is the SMILES notation for 8-tert-butyl-1,3-diazaspiro[4.5]decane-2,4-dione?
The canonical SMILES for 8-tert-butyl-1,3-diazaspiro[4.5]decane-2,4-dione is CC(C)(C)C1CCC2(CC1)NC(=O)NC2=O.
What is the InChIKey of 8-tert-butyl-1,3-diazaspiro[4.5]decane-2,4-dione?
The InChIKey is RQUKBTLNDXLLEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2/c1-11(2,3)8-4-6-12(7-5-8)9(15)13-10(16)14-12/h8H,4-7H2,1-3H3,(H2,13,14,15,16).
What are the key properties of 8-tert-butyl-1,3-diazaspiro[4.5]decane-2,4-dione?
8-tert-butyl-1,3-diazaspiro[4.5]decane-2,4-dione has a molecular weight of 224.30 g/mol, XLogP of 1.80, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-tert-butyl-1,3-diazaspiro[4.5]decane-2,4-dione is sourced from PubChem (CID 2374182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).