N-(2,5-dioxopyrrolidin-3-yl)-2-ethylbutanamide

C10H16N2O3 — CID 110461449

IUPACN-(2,5-dioxopyrrolidin-3-yl)-2-ethylbutanamide
SMILESCCC(CC)C(=O)NC1CC(=O)NC1=O
InChIInChI=1S/C10H16N2O3/c1-3-6(4-2)9(14)11-7-5-8(13)12-10(7)15/h6-7H,3-5H2,1-2H3,(H,11,14)(H,12,13,15)
InChIKeyVCSNNQIIDVVMGM-UHFFFAOYSA-N
MW212.25 g/mol
LogP-0.05
Rot. Bonds4

About N-(2,5-dioxopyrrolidin-3-yl)-2-ethylbutanamide

N-(2,5-dioxopyrrolidin-3-yl)-2-ethylbutanamide (PubChem CID 110461449) has the molecular formula C10H16N2O3 and a molecular weight of 212.25 g/mol. Its IUPAC name is N-(2,5-dioxopyrrolidin-3-yl)-2-ethylbutanamide.

Molecular Properties

Compound NameN-(2,5-dioxopyrrolidin-3-yl)-2-ethylbutanamide
PubChem CID110461449
Molecular FormulaC10H16N2O3
Molecular Weight212.25 g/mol
Exact Mass212.12
IUPAC NameN-(2,5-dioxopyrrolidin-3-yl)-2-ethylbutanamide
SMILESCCC(CC)C(=O)NC1CC(=O)NC1=O
InChIInChI=1S/C10H16N2O3/c1-3-6(4-2)9(14)11-7-5-8(13)12-10(7)15/h6-7H,3-5H2,1-2H3,(H,11,14)(H,12,13,15)
InChIKeyVCSNNQIIDVVMGM-UHFFFAOYSA-N
XLogP-0.05
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 5-0.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(dimethylamino)-N-(2,5-dioxopyrrolidin-3-yl)acetamide
CID 110479878
N-(2,5-dioxopyrrolidin-3-yl)-3-oxobutanamide
CID 110460593
methyl N-(2,5-dioxopyrrolidin-3-yl)carbamate
CID 110459456
N-(2,5-dioxopyrrolidin-3-yl)-2-morpholin-4-ylpropanamide
CID 110483747
3-[(3-ethyl-2-hydroxypentyl)amino]pyrrolidine-2,5-dione
CID 106285340
2-[(2,5-dioxopyrrolidin-3-yl)amino]-N,N-diethylpropanamide
CID 113408373
2-ethyl-N-(1-methyl-5-oxopyrrolidin-3-yl)butanamide
CID 60616692
3-(pent-1-yn-3-ylamino)pyrrolidine-2,5-dione
CID 106228611
N-(2,6-dioxopiperidin-3-yl)-2-sulfanylpropanamide
CID 107031614
N-cyclopropyl-2-ethylbutanamide
CID 5151098
3-(hydroxyamino)pyrrolidine-2,5-dione
CID 22569755
(3S)-3-(methylamino)pyrrolidine-2,5-dione
CID 98340872

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dioxopyrrolidin-3-yl)-2-ethylbutanamide?
The IUPAC name of N-(2,5-dioxopyrrolidin-3-yl)-2-ethylbutanamide (CID 110461449) is N-(2,5-dioxopyrrolidin-3-yl)-2-ethylbutanamide.
What is the SMILES notation for N-(2,5-dioxopyrrolidin-3-yl)-2-ethylbutanamide?
The canonical SMILES for N-(2,5-dioxopyrrolidin-3-yl)-2-ethylbutanamide is CCC(CC)C(=O)NC1CC(=O)NC1=O.
What is the InChIKey of N-(2,5-dioxopyrrolidin-3-yl)-2-ethylbutanamide?
The InChIKey is VCSNNQIIDVVMGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O3/c1-3-6(4-2)9(14)11-7-5-8(13)12-10(7)15/h6-7H,3-5H2,1-2H3,(H,11,14)(H,12,13,15).
What are the key properties of N-(2,5-dioxopyrrolidin-3-yl)-2-ethylbutanamide?
N-(2,5-dioxopyrrolidin-3-yl)-2-ethylbutanamide has a molecular weight of 212.25 g/mol, XLogP of -0.05, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dioxopyrrolidin-3-yl)-2-ethylbutanamide is sourced from PubChem (CID 110461449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).