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

C13H22N2O2 — CID 113282808

IUPAC2-(2-amino-2-methylpropyl)-2-azaspiro[4.5]decane-1,3-dione
SMILESCC(C)(N)CN1C(=O)CC2(CCCCC2)C1=O
InChIInChI=1S/C13H22N2O2/c1-12(2,14)9-15-10(16)8-13(11(15)17)6-4-3-5-7-13/h3-9,14H2,1-2H3
InChIKeyWHZSNYDCLOTLCR-UHFFFAOYSA-N
MW238.33 g/mol
LogP1.43
Rot. Bonds2

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

2-(2-amino-2-methylpropyl)-2-azaspiro[4.5]decane-1,3-dione (PubChem CID 113282808) has the molecular formula C13H22N2O2 and a molecular weight of 238.33 g/mol. Its IUPAC name is 2-(2-amino-2-methylpropyl)-2-azaspiro[4.5]decane-1,3-dione.

Molecular Properties

Compound Name2-(2-amino-2-methylpropyl)-2-azaspiro[4.5]decane-1,3-dione
PubChem CID113282808
Molecular FormulaC13H22N2O2
Molecular Weight238.33 g/mol
Exact Mass238.17
IUPAC Name2-(2-amino-2-methylpropyl)-2-azaspiro[4.5]decane-1,3-dione
SMILESCC(C)(N)CN1C(=O)CC2(CCCCC2)C1=O
InChIInChI=1S/C13H22N2O2/c1-12(2,14)9-15-10(16)8-13(11(15)17)6-4-3-5-7-13/h3-9,14H2,1-2H3
InChIKeyWHZSNYDCLOTLCR-UHFFFAOYSA-N
XLogP1.43
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-2-methylpropyl)-2-azaspiro[4.5]decane-1,3-dione?
The IUPAC name of 2-(2-amino-2-methylpropyl)-2-azaspiro[4.5]decane-1,3-dione (CID 113282808) is 2-(2-amino-2-methylpropyl)-2-azaspiro[4.5]decane-1,3-dione.
What is the SMILES notation for 2-(2-amino-2-methylpropyl)-2-azaspiro[4.5]decane-1,3-dione?
The canonical SMILES for 2-(2-amino-2-methylpropyl)-2-azaspiro[4.5]decane-1,3-dione is CC(C)(N)CN1C(=O)CC2(CCCCC2)C1=O.
What is the InChIKey of 2-(2-amino-2-methylpropyl)-2-azaspiro[4.5]decane-1,3-dione?
The InChIKey is WHZSNYDCLOTLCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O2/c1-12(2,14)9-15-10(16)8-13(11(15)17)6-4-3-5-7-13/h3-9,14H2,1-2H3.
What are the key properties of 2-(2-amino-2-methylpropyl)-2-azaspiro[4.5]decane-1,3-dione?
2-(2-amino-2-methylpropyl)-2-azaspiro[4.5]decane-1,3-dione has a molecular weight of 238.33 g/mol, XLogP of 1.43, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-2-methylpropyl)-2-azaspiro[4.5]decane-1,3-dione is sourced from PubChem (CID 113282808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).