N-(2,2-dimethylpropyl)-3-(2,5-dioxopyrrolidin-1-yl)propanamide

C12H20N2O3 — CID 56738112

IUPACN-(2,2-dimethylpropyl)-3-(2,5-dioxopyrrolidin-1-yl)propanamide
SMILESCC(C)(C)CNC(=O)CCN1C(=O)CCC1=O
InChIInChI=1S/C12H20N2O3/c1-12(2,3)8-13-9(15)6-7-14-10(16)4-5-11(14)17/h4-8H2,1-3H3,(H,13,15)
InChIKeyDMDKACRNWYCXBV-UHFFFAOYSA-N
MW240.30 g/mol
LogP0.69
Rot. Bonds4

About N-(2,2-dimethylpropyl)-3-(2,5-dioxopyrrolidin-1-yl)propanamide

N-(2,2-dimethylpropyl)-3-(2,5-dioxopyrrolidin-1-yl)propanamide (PubChem CID 56738112) has the molecular formula C12H20N2O3 and a molecular weight of 240.30 g/mol. Its IUPAC name is N-(2,2-dimethylpropyl)-3-(2,5-dioxopyrrolidin-1-yl)propanamide.

Molecular Properties

Compound NameN-(2,2-dimethylpropyl)-3-(2,5-dioxopyrrolidin-1-yl)propanamide
PubChem CID56738112
Molecular FormulaC12H20N2O3
Molecular Weight240.30 g/mol
Exact Mass240.15
IUPAC NameN-(2,2-dimethylpropyl)-3-(2,5-dioxopyrrolidin-1-yl)propanamide
SMILESCC(C)(C)CNC(=O)CCN1C(=O)CCC1=O
InChIInChI=1S/C12H20N2O3/c1-12(2,3)8-13-9(15)6-7-14-10(16)4-5-11(14)17/h4-8H2,1-3H3,(H,13,15)
InChIKeyDMDKACRNWYCXBV-UHFFFAOYSA-N
XLogP0.69
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.30
LogP ≤ 50.69
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 N-(2,2-dimethylpropyl)-3-(2,5-dioxopyrrolidin-1-yl)propanamide?
The IUPAC name of N-(2,2-dimethylpropyl)-3-(2,5-dioxopyrrolidin-1-yl)propanamide (CID 56738112) is N-(2,2-dimethylpropyl)-3-(2,5-dioxopyrrolidin-1-yl)propanamide.
What is the SMILES notation for N-(2,2-dimethylpropyl)-3-(2,5-dioxopyrrolidin-1-yl)propanamide?
The canonical SMILES for N-(2,2-dimethylpropyl)-3-(2,5-dioxopyrrolidin-1-yl)propanamide is CC(C)(C)CNC(=O)CCN1C(=O)CCC1=O.
What is the InChIKey of N-(2,2-dimethylpropyl)-3-(2,5-dioxopyrrolidin-1-yl)propanamide?
The InChIKey is DMDKACRNWYCXBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O3/c1-12(2,3)8-13-9(15)6-7-14-10(16)4-5-11(14)17/h4-8H2,1-3H3,(H,13,15).
What are the key properties of N-(2,2-dimethylpropyl)-3-(2,5-dioxopyrrolidin-1-yl)propanamide?
N-(2,2-dimethylpropyl)-3-(2,5-dioxopyrrolidin-1-yl)propanamide has a molecular weight of 240.30 g/mol, XLogP of 0.69, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethylpropyl)-3-(2,5-dioxopyrrolidin-1-yl)propanamide is sourced from PubChem (CID 56738112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).