1-ethyl-3-[(1-oxo-1-piperidin-1-ylpropan-2-yl)amino]pyrrolidine-2,5-dione

C14H23N3O3 — CID 60934113

IUPAC1-ethyl-3-[(1-oxo-1-piperidin-1-ylpropan-2-yl)amino]pyrrolidine-2,5-dione
SMILESCCN1C(=O)CC(NC(C)C(=O)N2CCCCC2)C1=O
InChIInChI=1S/C14H23N3O3/c1-3-17-12(18)9-11(14(17)20)15-10(2)13(19)16-7-5-4-6-8-16/h10-11,15H,3-9H2,1-2H3
InChIKeyINNPATJKIFRIEE-UHFFFAOYSA-N
MW281.36 g/mol
LogP0.12
Rot. Bonds4

About 1-ethyl-3-[(1-oxo-1-piperidin-1-ylpropan-2-yl)amino]pyrrolidine-2,5-dione

1-ethyl-3-[(1-oxo-1-piperidin-1-ylpropan-2-yl)amino]pyrrolidine-2,5-dione (PubChem CID 60934113) has the molecular formula C14H23N3O3 and a molecular weight of 281.36 g/mol. Its IUPAC name is 1-ethyl-3-[(1-oxo-1-piperidin-1-ylpropan-2-yl)amino]pyrrolidine-2,5-dione.

Molecular Properties

Compound Name1-ethyl-3-[(1-oxo-1-piperidin-1-ylpropan-2-yl)amino]pyrrolidine-2,5-dione
PubChem CID60934113
Molecular FormulaC14H23N3O3
Molecular Weight281.36 g/mol
Exact Mass281.17
IUPAC Name1-ethyl-3-[(1-oxo-1-piperidin-1-ylpropan-2-yl)amino]pyrrolidine-2,5-dione
SMILESCCN1C(=O)CC(NC(C)C(=O)N2CCCCC2)C1=O
InChIInChI=1S/C14H23N3O3/c1-3-17-12(18)9-11(14(17)20)15-10(2)13(19)16-7-5-4-6-8-16/h10-11,15H,3-9H2,1-2H3
InChIKeyINNPATJKIFRIEE-UHFFFAOYSA-N
XLogP0.12
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 50.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 1-ethyl-3-[(1-oxo-1-piperidin-1-ylpropan-2-yl)amino]pyrrolidine-2,5-dione with MolForge

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Related Compounds

1-ethyl-3-(methylamino)pyrrolidine-2,5-dione
CID 43636114
1-ethyl-3-(1-phenylethylamino)pyrrolidine-2,5-dione
CID 43636150
3-[[1-(azepan-1-yl)-1-oxopropan-2-yl]amino]piperidin-2-one
CID 62093429
1-(azepan-1-yl)-2-[(2-ethylcyclopropyl)amino]propan-1-one
CID 114108217
1-(azepan-1-yl)-2-(cyclopentylamino)propan-1-one
CID 43087090
2-(cyclopentylamino)-1-piperidin-1-ylpropan-1-one
CID 43083612
2-(cycloheptylamino)-1-pyrrolidin-1-ylpropan-1-one
CID 43236389
2-[(1-methyl-2,5-dioxopyrrolidin-3-yl)amino]propanoic acid
CID 43638674
1-(azepan-1-yl)-2-(2-methylpropoxyamino)propan-1-one
CID 82723078
2-(pentan-3-ylamino)-1-piperidin-1-ylpropan-1-one
CID 43083625
1-(azepan-1-yl)-2-[(2,2,3,3-tetramethylcyclopropyl)amino]propan-1-one
CID 79358748
2-methyl-N-(1-oxo-1-piperidin-1-ylpropan-2-yl)butanamide
CID 110280633

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-[(1-oxo-1-piperidin-1-ylpropan-2-yl)amino]pyrrolidine-2,5-dione?
The IUPAC name of 1-ethyl-3-[(1-oxo-1-piperidin-1-ylpropan-2-yl)amino]pyrrolidine-2,5-dione (CID 60934113) is 1-ethyl-3-[(1-oxo-1-piperidin-1-ylpropan-2-yl)amino]pyrrolidine-2,5-dione.
What is the SMILES notation for 1-ethyl-3-[(1-oxo-1-piperidin-1-ylpropan-2-yl)amino]pyrrolidine-2,5-dione?
The canonical SMILES for 1-ethyl-3-[(1-oxo-1-piperidin-1-ylpropan-2-yl)amino]pyrrolidine-2,5-dione is CCN1C(=O)CC(NC(C)C(=O)N2CCCCC2)C1=O.
What is the InChIKey of 1-ethyl-3-[(1-oxo-1-piperidin-1-ylpropan-2-yl)amino]pyrrolidine-2,5-dione?
The InChIKey is INNPATJKIFRIEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O3/c1-3-17-12(18)9-11(14(17)20)15-10(2)13(19)16-7-5-4-6-8-16/h10-11,15H,3-9H2,1-2H3.
What are the key properties of 1-ethyl-3-[(1-oxo-1-piperidin-1-ylpropan-2-yl)amino]pyrrolidine-2,5-dione?
1-ethyl-3-[(1-oxo-1-piperidin-1-ylpropan-2-yl)amino]pyrrolidine-2,5-dione has a molecular weight of 281.36 g/mol, XLogP of 0.12, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-[(1-oxo-1-piperidin-1-ylpropan-2-yl)amino]pyrrolidine-2,5-dione is sourced from PubChem (CID 60934113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).