2-(3-amino-2-methylpropyl)-2-azaspiro[4.5]decane-1,3-dione

C13H22N2O2 — CID 62667991

IUPAC2-(3-amino-2-methylpropyl)-2-azaspiro[4.5]decane-1,3-dione
SMILESCC(CN)CN1C(=O)CC2(CCCCC2)C1=O
InChIInChI=1S/C13H22N2O2/c1-10(8-14)9-15-11(16)7-13(12(15)17)5-3-2-4-6-13/h10H,2-9,14H2,1H3
InChIKeyNQVUQFKHBPFKEN-UHFFFAOYSA-N
MW238.33 g/mol
LogP1.29
Rot. Bonds3

About 2-(3-amino-2-methylpropyl)-2-azaspiro[4.5]decane-1,3-dione

2-(3-amino-2-methylpropyl)-2-azaspiro[4.5]decane-1,3-dione (PubChem CID 62667991) has the molecular formula C13H22N2O2 and a molecular weight of 238.33 g/mol. Its IUPAC name is 2-(3-amino-2-methylpropyl)-2-azaspiro[4.5]decane-1,3-dione.

Molecular Properties

Compound Name2-(3-amino-2-methylpropyl)-2-azaspiro[4.5]decane-1,3-dione
PubChem CID62667991
Molecular FormulaC13H22N2O2
Molecular Weight238.33 g/mol
Exact Mass238.17
IUPAC Name2-(3-amino-2-methylpropyl)-2-azaspiro[4.5]decane-1,3-dione
SMILESCC(CN)CN1C(=O)CC2(CCCCC2)C1=O
InChIInChI=1S/C13H22N2O2/c1-10(8-14)9-15-11(16)7-13(12(15)17)5-3-2-4-6-13/h10H,2-9,14H2,1H3
InChIKeyNQVUQFKHBPFKEN-UHFFFAOYSA-N
XLogP1.29
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-(3-amino-2-methylpropyl)-2-azaspiro[4.5]decane-1,3-dione 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-(3-amino-2-methylpropyl)-2-azaspiro[4.5]decane-1,3-dione?
The IUPAC name of 2-(3-amino-2-methylpropyl)-2-azaspiro[4.5]decane-1,3-dione (CID 62667991) is 2-(3-amino-2-methylpropyl)-2-azaspiro[4.5]decane-1,3-dione.
What is the SMILES notation for 2-(3-amino-2-methylpropyl)-2-azaspiro[4.5]decane-1,3-dione?
The canonical SMILES for 2-(3-amino-2-methylpropyl)-2-azaspiro[4.5]decane-1,3-dione is CC(CN)CN1C(=O)CC2(CCCCC2)C1=O.
What is the InChIKey of 2-(3-amino-2-methylpropyl)-2-azaspiro[4.5]decane-1,3-dione?
The InChIKey is NQVUQFKHBPFKEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O2/c1-10(8-14)9-15-11(16)7-13(12(15)17)5-3-2-4-6-13/h10H,2-9,14H2,1H3.
What are the key properties of 2-(3-amino-2-methylpropyl)-2-azaspiro[4.5]decane-1,3-dione?
2-(3-amino-2-methylpropyl)-2-azaspiro[4.5]decane-1,3-dione has a molecular weight of 238.33 g/mol, XLogP of 1.29, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-amino-2-methylpropyl)-2-azaspiro[4.5]decane-1,3-dione is sourced from PubChem (CID 62667991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).