1-(2-amino-2-ethylbutyl)-3,3-diethylpyrrolidine-2,5-dione

C14H26N2O2 — CID 113283325

IUPAC1-(2-amino-2-ethylbutyl)-3,3-diethylpyrrolidine-2,5-dione
SMILESCCC(N)(CC)CN1C(=O)CC(CC)(CC)C1=O
InChIInChI=1S/C14H26N2O2/c1-5-13(6-2)9-11(17)16(12(13)18)10-14(15,7-3)8-4/h5-10,15H2,1-4H3
InChIKeyTXLFNUOGIQNXLQ-UHFFFAOYSA-N
MW254.37 g/mol
LogP2.07
Rot. Bonds6

About 1-(2-amino-2-ethylbutyl)-3,3-diethylpyrrolidine-2,5-dione

1-(2-amino-2-ethylbutyl)-3,3-diethylpyrrolidine-2,5-dione (PubChem CID 113283325) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is 1-(2-amino-2-ethylbutyl)-3,3-diethylpyrrolidine-2,5-dione.

Molecular Properties

Compound Name1-(2-amino-2-ethylbutyl)-3,3-diethylpyrrolidine-2,5-dione
PubChem CID113283325
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC Name1-(2-amino-2-ethylbutyl)-3,3-diethylpyrrolidine-2,5-dione
SMILESCCC(N)(CC)CN1C(=O)CC(CC)(CC)C1=O
InChIInChI=1S/C14H26N2O2/c1-5-13(6-2)9-11(17)16(12(13)18)10-14(15,7-3)8-4/h5-10,15H2,1-4H3
InChIKeyTXLFNUOGIQNXLQ-UHFFFAOYSA-N
XLogP2.07
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 1-(2-amino-2-ethylbutyl)-3,3-diethylpyrrolidine-2,5-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 1-(2-amino-2-ethylbutyl)-3,3-diethylpyrrolidine-2,5-dione?
The IUPAC name of 1-(2-amino-2-ethylbutyl)-3,3-diethylpyrrolidine-2,5-dione (CID 113283325) is 1-(2-amino-2-ethylbutyl)-3,3-diethylpyrrolidine-2,5-dione.
What is the SMILES notation for 1-(2-amino-2-ethylbutyl)-3,3-diethylpyrrolidine-2,5-dione?
The canonical SMILES for 1-(2-amino-2-ethylbutyl)-3,3-diethylpyrrolidine-2,5-dione is CCC(N)(CC)CN1C(=O)CC(CC)(CC)C1=O.
What is the InChIKey of 1-(2-amino-2-ethylbutyl)-3,3-diethylpyrrolidine-2,5-dione?
The InChIKey is TXLFNUOGIQNXLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-5-13(6-2)9-11(17)16(12(13)18)10-14(15,7-3)8-4/h5-10,15H2,1-4H3.
What are the key properties of 1-(2-amino-2-ethylbutyl)-3,3-diethylpyrrolidine-2,5-dione?
1-(2-amino-2-ethylbutyl)-3,3-diethylpyrrolidine-2,5-dione has a molecular weight of 254.37 g/mol, XLogP of 2.07, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-amino-2-ethylbutyl)-3,3-diethylpyrrolidine-2,5-dione is sourced from PubChem (CID 113283325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).