1-(1-amino-3-methylbutan-2-yl)-3-methyl-3-propan-2-ylpyrrolidine-2,5-dione

C13H24N2O2 — CID 65191993

IUPAC1-(1-amino-3-methylbutan-2-yl)-3-methyl-3-propan-2-ylpyrrolidine-2,5-dione
SMILESCC(C)C(CN)N1C(=O)CC(C)(C(C)C)C1=O
InChIInChI=1S/C13H24N2O2/c1-8(2)10(7-14)15-11(16)6-13(5,9(3)4)12(15)17/h8-10H,6-7,14H2,1-5H3
InChIKeyWOHRXDZVDXKAME-UHFFFAOYSA-N
MW240.35 g/mol
LogP1.39
Rot. Bonds4

About 1-(1-amino-3-methylbutan-2-yl)-3-methyl-3-propan-2-ylpyrrolidine-2,5-dione

1-(1-amino-3-methylbutan-2-yl)-3-methyl-3-propan-2-ylpyrrolidine-2,5-dione (PubChem CID 65191993) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 1-(1-amino-3-methylbutan-2-yl)-3-methyl-3-propan-2-ylpyrrolidine-2,5-dione.

Molecular Properties

Compound Name1-(1-amino-3-methylbutan-2-yl)-3-methyl-3-propan-2-ylpyrrolidine-2,5-dione
PubChem CID65191993
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name1-(1-amino-3-methylbutan-2-yl)-3-methyl-3-propan-2-ylpyrrolidine-2,5-dione
SMILESCC(C)C(CN)N1C(=O)CC(C)(C(C)C)C1=O
InChIInChI=1S/C13H24N2O2/c1-8(2)10(7-14)15-11(16)6-13(5,9(3)4)12(15)17/h8-10H,6-7,14H2,1-5H3
InChIKeyWOHRXDZVDXKAME-UHFFFAOYSA-N
XLogP1.39
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 51.39
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 1-(1-amino-3-methylbutan-2-yl)-3-methyl-3-propan-2-ylpyrrolidine-2,5-dione?
The IUPAC name of 1-(1-amino-3-methylbutan-2-yl)-3-methyl-3-propan-2-ylpyrrolidine-2,5-dione (CID 65191993) is 1-(1-amino-3-methylbutan-2-yl)-3-methyl-3-propan-2-ylpyrrolidine-2,5-dione.
What is the SMILES notation for 1-(1-amino-3-methylbutan-2-yl)-3-methyl-3-propan-2-ylpyrrolidine-2,5-dione?
The canonical SMILES for 1-(1-amino-3-methylbutan-2-yl)-3-methyl-3-propan-2-ylpyrrolidine-2,5-dione is CC(C)C(CN)N1C(=O)CC(C)(C(C)C)C1=O.
What is the InChIKey of 1-(1-amino-3-methylbutan-2-yl)-3-methyl-3-propan-2-ylpyrrolidine-2,5-dione?
The InChIKey is WOHRXDZVDXKAME-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-8(2)10(7-14)15-11(16)6-13(5,9(3)4)12(15)17/h8-10H,6-7,14H2,1-5H3.
What are the key properties of 1-(1-amino-3-methylbutan-2-yl)-3-methyl-3-propan-2-ylpyrrolidine-2,5-dione?
1-(1-amino-3-methylbutan-2-yl)-3-methyl-3-propan-2-ylpyrrolidine-2,5-dione has a molecular weight of 240.35 g/mol, XLogP of 1.39, 4 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-methyl-3-propan-2-ylpyrrolidine-2,5-dione is sourced from PubChem (CID 65191993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).