1-amino-3,4-dimethylpyrrolidine-2,5-dione

C6H10N2O2 — CID 89484333

IUPAC1-amino-3,4-dimethylpyrrolidine-2,5-dione
SMILESCC1C(=O)N(N)C(=O)C1C
InChIInChI=1S/C6H10N2O2/c1-3-4(2)6(10)8(7)5(3)9/h3-4H,7H2,1-2H3
InChIKeyHZJNYJGOFZGIEA-UHFFFAOYSA-N
MW142.16 g/mol
LogP-0.50
Rot. Bonds

About 1-amino-3,4-dimethylpyrrolidine-2,5-dione

1-amino-3,4-dimethylpyrrolidine-2,5-dione (PubChem CID 89484333) has the molecular formula C6H10N2O2 and a molecular weight of 142.16 g/mol. Its IUPAC name is 1-amino-3,4-dimethylpyrrolidine-2,5-dione.

Molecular Properties

Compound Name1-amino-3,4-dimethylpyrrolidine-2,5-dione
PubChem CID89484333
Molecular FormulaC6H10N2O2
Molecular Weight142.16 g/mol
Exact Mass142.07
IUPAC Name1-amino-3,4-dimethylpyrrolidine-2,5-dione
SMILESCC1C(=O)N(N)C(=O)C1C
InChIInChI=1S/C6H10N2O2/c1-3-4(2)6(10)8(7)5(3)9/h3-4H,7H2,1-2H3
InChIKeyHZJNYJGOFZGIEA-UHFFFAOYSA-N
XLogP-0.50
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.16
LogP ≤ 5-0.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-amino-3,4-dimethylpyrrolidine-2,5-dione?
The IUPAC name of 1-amino-3,4-dimethylpyrrolidine-2,5-dione (CID 89484333) is 1-amino-3,4-dimethylpyrrolidine-2,5-dione.
What is the SMILES notation for 1-amino-3,4-dimethylpyrrolidine-2,5-dione?
The canonical SMILES for 1-amino-3,4-dimethylpyrrolidine-2,5-dione is CC1C(=O)N(N)C(=O)C1C.
What is the InChIKey of 1-amino-3,4-dimethylpyrrolidine-2,5-dione?
The InChIKey is HZJNYJGOFZGIEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O2/c1-3-4(2)6(10)8(7)5(3)9/h3-4H,7H2,1-2H3.
What are the key properties of 1-amino-3,4-dimethylpyrrolidine-2,5-dione?
1-amino-3,4-dimethylpyrrolidine-2,5-dione has a molecular weight of 142.16 g/mol, XLogP of -0.50, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-3,4-dimethylpyrrolidine-2,5-dione is sourced from PubChem (CID 89484333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).