1-(1-amino-3-methylbutan-2-yl)-3-methylpyrrolidine-2,5-dione

C10H18N2O2 — CID 65191994

IUPAC1-(1-amino-3-methylbutan-2-yl)-3-methylpyrrolidine-2,5-dione
SMILESCC1CC(=O)N(C(CN)C(C)C)C1=O
InChIInChI=1S/C10H18N2O2/c1-6(2)8(5-11)12-9(13)4-7(3)10(12)14/h6-8H,4-5,11H2,1-3H3
InChIKeyLEAXBJJUIQIPDN-UHFFFAOYSA-N
MW198.27 g/mol
LogP0.36
Rot. Bonds3

About 1-(1-amino-3-methylbutan-2-yl)-3-methylpyrrolidine-2,5-dione

1-(1-amino-3-methylbutan-2-yl)-3-methylpyrrolidine-2,5-dione (PubChem CID 65191994) has the molecular formula C10H18N2O2 and a molecular weight of 198.27 g/mol. Its IUPAC name is 1-(1-amino-3-methylbutan-2-yl)-3-methylpyrrolidine-2,5-dione.

Molecular Properties

Compound Name1-(1-amino-3-methylbutan-2-yl)-3-methylpyrrolidine-2,5-dione
PubChem CID65191994
Molecular FormulaC10H18N2O2
Molecular Weight198.27 g/mol
Exact Mass198.14
IUPAC Name1-(1-amino-3-methylbutan-2-yl)-3-methylpyrrolidine-2,5-dione
SMILESCC1CC(=O)N(C(CN)C(C)C)C1=O
InChIInChI=1S/C10H18N2O2/c1-6(2)8(5-11)12-9(13)4-7(3)10(12)14/h6-8H,4-5,11H2,1-3H3
InChIKeyLEAXBJJUIQIPDN-UHFFFAOYSA-N
XLogP0.36
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 50.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 1-(1-amino-3-methylbutan-2-yl)-3-methylpyrrolidine-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

Related Compounds

4-(1-amino-3-methylbutan-2-yl)thiomorpholine-3,5-dione
CID 104571018
2-(1-amino-3-methylbutan-2-yl)-4,5,6,6a-tetrahydro-3aH-cyclopenta[c]pyrrole-1,3-dione
CID 103980108
3-(3-methyl-2,5-dioxopyrrolidin-1-yl)butanenitrile
CID 61238282
3-(3-methyl-2,5-dioxopyrrolidin-1-yl)butanethioamide
CID 61238292
2-(3-methyl-2,5-dioxopyrrolidin-1-yl)propanenitrile
CID 61121941
2-(3-methyl-2,5-dioxopyrrolidin-1-yl)propanoic acid
CID 58728330
2-(3-methyl-2,5-dioxopyrrolidin-1-yl)pentanoic acid
CID 61036813
2-(3-methyl-2,5-dioxopyrrolidin-1-yl)butanenitrile
CID 61123330
1-(1-hydroxy-3-methylbutan-2-yl)-4-methylpiperidine-2,6-dione
CID 79244368
2-(3-methyl-2,5-dioxopyrrolidin-1-yl)hexanoic acid
CID 61036684
2-methyl-6-(3-methyl-2,5-dioxopyrrolidin-1-yl)heptanoic acid
CID 65284889
1-(1-amino-3-methylbutan-2-yl)-3-methyl-3-propan-2-ylpyrrolidine-2,5-dione
CID 65191993

Frequently Asked Questions

What is the IUPAC name of 1-(1-amino-3-methylbutan-2-yl)-3-methylpyrrolidine-2,5-dione?
The IUPAC name of 1-(1-amino-3-methylbutan-2-yl)-3-methylpyrrolidine-2,5-dione (CID 65191994) is 1-(1-amino-3-methylbutan-2-yl)-3-methylpyrrolidine-2,5-dione.
What is the SMILES notation for 1-(1-amino-3-methylbutan-2-yl)-3-methylpyrrolidine-2,5-dione?
The canonical SMILES for 1-(1-amino-3-methylbutan-2-yl)-3-methylpyrrolidine-2,5-dione is CC1CC(=O)N(C(CN)C(C)C)C1=O.
What is the InChIKey of 1-(1-amino-3-methylbutan-2-yl)-3-methylpyrrolidine-2,5-dione?
The InChIKey is LEAXBJJUIQIPDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2/c1-6(2)8(5-11)12-9(13)4-7(3)10(12)14/h6-8H,4-5,11H2,1-3H3.
What are the key properties of 1-(1-amino-3-methylbutan-2-yl)-3-methylpyrrolidine-2,5-dione?
1-(1-amino-3-methylbutan-2-yl)-3-methylpyrrolidine-2,5-dione has a molecular weight of 198.27 g/mol, XLogP of 0.36, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-amino-3-methylbutan-2-yl)-3-methylpyrrolidine-2,5-dione is sourced from PubChem (CID 65191994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).