2-ethyl-N-(5-oxo-1-propan-2-ylpyrrolidin-3-yl)butanamide

C13H24N2O2 — CID 110736652

IUPAC2-ethyl-N-(5-oxo-1-propan-2-ylpyrrolidin-3-yl)butanamide
SMILESCCC(CC)C(=O)NC1CC(=O)N(C(C)C)C1
InChIInChI=1S/C13H24N2O2/c1-5-10(6-2)13(17)14-11-7-12(16)15(8-11)9(3)4/h9-11H,5-8H2,1-4H3,(H,14,17)
InChIKeyFOZGGIWBQVTULT-UHFFFAOYSA-N
MW240.35 g/mol
LogP1.55
Rot. Bonds5

About 2-ethyl-N-(5-oxo-1-propan-2-ylpyrrolidin-3-yl)butanamide

2-ethyl-N-(5-oxo-1-propan-2-ylpyrrolidin-3-yl)butanamide (PubChem CID 110736652) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 2-ethyl-N-(5-oxo-1-propan-2-ylpyrrolidin-3-yl)butanamide.

Molecular Properties

Compound Name2-ethyl-N-(5-oxo-1-propan-2-ylpyrrolidin-3-yl)butanamide
PubChem CID110736652
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name2-ethyl-N-(5-oxo-1-propan-2-ylpyrrolidin-3-yl)butanamide
SMILESCCC(CC)C(=O)NC1CC(=O)N(C(C)C)C1
InChIInChI=1S/C13H24N2O2/c1-5-10(6-2)13(17)14-11-7-12(16)15(8-11)9(3)4/h9-11H,5-8H2,1-4H3,(H,14,17)
InChIKeyFOZGGIWBQVTULT-UHFFFAOYSA-N
XLogP1.55
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethyl-N-(1-methyl-5-oxopyrrolidin-3-yl)butanamide
CID 60616692
1-butyl-3-(5-oxo-1-propan-2-ylpyrrolidin-3-yl)urea
CID 108876777
N-(5-oxo-1-propan-2-ylpyrrolidin-3-yl)pentadecanamide
CID 167356963
tert-butyl N-[(3S)-5-oxo-1-propan-2-ylpyrrolidin-3-yl]carbamate
CID 168817443
1-(2-butan-2-ylphenyl)-3-(5-oxo-1-propan-2-ylpyrrolidin-3-yl)urea
CID 108877028
1-(2-chloroethyl)-3-(5-oxo-1-propan-2-ylpyrrolidin-3-yl)urea
CID 108876829
2-(2-methylphenyl)-N-(5-oxo-1-propan-2-ylpyrrolidin-3-yl)acetamide
CID 110736726
3-(2-methylphenyl)-N-(5-oxo-1-propan-2-ylpyrrolidin-3-yl)propanamide
CID 110736722
2-(4-bromophenyl)-N-(5-oxo-1-propan-2-ylpyrrolidin-3-yl)acetamide
CID 110736735
2-[[(5-oxo-1-propan-2-ylpyrrolidine-3-carbonyl)amino]methyl]butanoic acid
CID 65220584
2-(4-methoxyphenyl)-N-(5-oxo-1-propan-2-ylpyrrolidin-3-yl)acetamide
CID 110736682
1,1-dibenzyl-3-(5-oxo-1-propan-2-ylpyrrolidin-3-yl)urea
CID 108876896

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-(5-oxo-1-propan-2-ylpyrrolidin-3-yl)butanamide?
The IUPAC name of 2-ethyl-N-(5-oxo-1-propan-2-ylpyrrolidin-3-yl)butanamide (CID 110736652) is 2-ethyl-N-(5-oxo-1-propan-2-ylpyrrolidin-3-yl)butanamide.
What is the SMILES notation for 2-ethyl-N-(5-oxo-1-propan-2-ylpyrrolidin-3-yl)butanamide?
The canonical SMILES for 2-ethyl-N-(5-oxo-1-propan-2-ylpyrrolidin-3-yl)butanamide is CCC(CC)C(=O)NC1CC(=O)N(C(C)C)C1.
What is the InChIKey of 2-ethyl-N-(5-oxo-1-propan-2-ylpyrrolidin-3-yl)butanamide?
The InChIKey is FOZGGIWBQVTULT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-5-10(6-2)13(17)14-11-7-12(16)15(8-11)9(3)4/h9-11H,5-8H2,1-4H3,(H,14,17).
What are the key properties of 2-ethyl-N-(5-oxo-1-propan-2-ylpyrrolidin-3-yl)butanamide?
2-ethyl-N-(5-oxo-1-propan-2-ylpyrrolidin-3-yl)butanamide has a molecular weight of 240.35 g/mol, XLogP of 1.55, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-(5-oxo-1-propan-2-ylpyrrolidin-3-yl)butanamide is sourced from PubChem (CID 110736652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).