N-(2,5-dioxopyrrolidin-1-yl)-N-propylpropanamide

C10H16N2O3 — CID 118234728

IUPACN-(2,5-dioxopyrrolidin-1-yl)-N-propylpropanamide
SMILESCCCN(C(=O)CC)N1C(=O)CCC1=O
InChIInChI=1S/C10H16N2O3/c1-3-7-11(8(13)4-2)12-9(14)5-6-10(12)15/h3-7H2,1-2H3
InChIKeyIOSCFDZJSLWVPX-UHFFFAOYSA-N
MW212.25 g/mol
LogP0.70
Rot. Bonds4

About N-(2,5-dioxopyrrolidin-1-yl)-N-propylpropanamide

N-(2,5-dioxopyrrolidin-1-yl)-N-propylpropanamide (PubChem CID 118234728) has the molecular formula C10H16N2O3 and a molecular weight of 212.25 g/mol. Its IUPAC name is N-(2,5-dioxopyrrolidin-1-yl)-N-propylpropanamide.

Molecular Properties

Compound NameN-(2,5-dioxopyrrolidin-1-yl)-N-propylpropanamide
PubChem CID118234728
Molecular FormulaC10H16N2O3
Molecular Weight212.25 g/mol
Exact Mass212.12
IUPAC NameN-(2,5-dioxopyrrolidin-1-yl)-N-propylpropanamide
SMILESCCCN(C(=O)CC)N1C(=O)CCC1=O
InChIInChI=1S/C10H16N2O3/c1-3-7-11(8(13)4-2)12-9(14)5-6-10(12)15/h3-7H2,1-2H3
InChIKeyIOSCFDZJSLWVPX-UHFFFAOYSA-N
XLogP0.70
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 50.70
H-Bond Donors ≤ 50
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-(2,5-dioxopyrrolidin-1-yl)-N-propylpropanamide?
The IUPAC name of N-(2,5-dioxopyrrolidin-1-yl)-N-propylpropanamide (CID 118234728) is N-(2,5-dioxopyrrolidin-1-yl)-N-propylpropanamide.
What is the SMILES notation for N-(2,5-dioxopyrrolidin-1-yl)-N-propylpropanamide?
The canonical SMILES for N-(2,5-dioxopyrrolidin-1-yl)-N-propylpropanamide is CCCN(C(=O)CC)N1C(=O)CCC1=O.
What is the InChIKey of N-(2,5-dioxopyrrolidin-1-yl)-N-propylpropanamide?
The InChIKey is IOSCFDZJSLWVPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O3/c1-3-7-11(8(13)4-2)12-9(14)5-6-10(12)15/h3-7H2,1-2H3.
What are the key properties of N-(2,5-dioxopyrrolidin-1-yl)-N-propylpropanamide?
N-(2,5-dioxopyrrolidin-1-yl)-N-propylpropanamide has a molecular weight of 212.25 g/mol, XLogP of 0.70, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dioxopyrrolidin-1-yl)-N-propylpropanamide is sourced from PubChem (CID 118234728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).