2,4,10-trioxo-1,3,9-triazaspiro[4.5]decane-9-carboxamide

C8H10N4O4 — CID 123255858

IUPAC2,4,10-trioxo-1,3,9-triazaspiro[4.5]decane-9-carboxamide
SMILESNC(=O)N1CCCC2(NC(=O)NC2=O)C1=O
InChIInChI=1S/C8H10N4O4/c9-6(15)12-3-1-2-8(5(12)14)4(13)10-7(16)11-8/h1-3H2,(H2,9,15)(H2,10,11,13,16)
InChIKeyFKPRJTQNWREKAG-UHFFFAOYSA-N
MW226.19 g/mol
LogP-1.73
Rot. Bonds

About 2,4,10-trioxo-1,3,9-triazaspiro[4.5]decane-9-carboxamide

2,4,10-trioxo-1,3,9-triazaspiro[4.5]decane-9-carboxamide (PubChem CID 123255858) has the molecular formula C8H10N4O4 and a molecular weight of 226.19 g/mol. Its IUPAC name is 2,4,10-trioxo-1,3,9-triazaspiro[4.5]decane-9-carboxamide.

Molecular Properties

Compound Name2,4,10-trioxo-1,3,9-triazaspiro[4.5]decane-9-carboxamide
PubChem CID123255858
Molecular FormulaC8H10N4O4
Molecular Weight226.19 g/mol
Exact Mass226.07
IUPAC Name2,4,10-trioxo-1,3,9-triazaspiro[4.5]decane-9-carboxamide
SMILESNC(=O)N1CCCC2(NC(=O)NC2=O)C1=O
InChIInChI=1S/C8H10N4O4/c9-6(15)12-3-1-2-8(5(12)14)4(13)10-7(16)11-8/h1-3H2,(H2,9,15)(H2,10,11,13,16)
InChIKeyFKPRJTQNWREKAG-UHFFFAOYSA-N
XLogP-1.73
TPSA121.60 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.19
LogP ≤ 5-1.73
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'hydantoin', 'substructure': 'N/A'}

Analyze 2,4,10-trioxo-1,3,9-triazaspiro[4.5]decane-9-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,4,10-trioxo-1,3,9-triazaspiro[4.5]decane-9-carboxamide?
The IUPAC name of 2,4,10-trioxo-1,3,9-triazaspiro[4.5]decane-9-carboxamide (CID 123255858) is 2,4,10-trioxo-1,3,9-triazaspiro[4.5]decane-9-carboxamide.
What is the SMILES notation for 2,4,10-trioxo-1,3,9-triazaspiro[4.5]decane-9-carboxamide?
The canonical SMILES for 2,4,10-trioxo-1,3,9-triazaspiro[4.5]decane-9-carboxamide is NC(=O)N1CCCC2(NC(=O)NC2=O)C1=O.
What is the InChIKey of 2,4,10-trioxo-1,3,9-triazaspiro[4.5]decane-9-carboxamide?
The InChIKey is FKPRJTQNWREKAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N4O4/c9-6(15)12-3-1-2-8(5(12)14)4(13)10-7(16)11-8/h1-3H2,(H2,9,15)(H2,10,11,13,16).
What are the key properties of 2,4,10-trioxo-1,3,9-triazaspiro[4.5]decane-9-carboxamide?
2,4,10-trioxo-1,3,9-triazaspiro[4.5]decane-9-carboxamide has a molecular weight of 226.19 g/mol, XLogP of -1.73, 0 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,10-trioxo-1,3,9-triazaspiro[4.5]decane-9-carboxamide is sourced from PubChem (CID 123255858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).