2-[[2,5-dioxo-1-(2-phenylethyl)pyrrolidin-3-yl]amino]acetamide

C14H17N3O3 — CID 3126833

IUPAC2-[[2,5-dioxo-1-(2-phenylethyl)pyrrolidin-3-yl]amino]acetamide
SMILESNC(=O)CNC1CC(=O)N(CCc2ccccc2)C1=O
InChIInChI=1S/C14H17N3O3/c15-12(18)9-16-11-8-13(19)17(14(11)20)7-6-10-4-2-1-3-5-10/h1-5,11,16H,6-9H2,(H2,15,18)
InChIKeyZPKKFOVMSUNTMS-UHFFFAOYSA-N
MW275.31 g/mol
LogP-0.57
Rot. Bonds6

About 2-[[2,5-dioxo-1-(2-phenylethyl)pyrrolidin-3-yl]amino]acetamide

2-[[2,5-dioxo-1-(2-phenylethyl)pyrrolidin-3-yl]amino]acetamide (PubChem CID 3126833) has the molecular formula C14H17N3O3 and a molecular weight of 275.31 g/mol. Its IUPAC name is 2-[[2,5-dioxo-1-(2-phenylethyl)pyrrolidin-3-yl]amino]acetamide.

Molecular Properties

Compound Name2-[[2,5-dioxo-1-(2-phenylethyl)pyrrolidin-3-yl]amino]acetamide
PubChem CID3126833
Molecular FormulaC14H17N3O3
Molecular Weight275.31 g/mol
Exact Mass275.13
IUPAC Name2-[[2,5-dioxo-1-(2-phenylethyl)pyrrolidin-3-yl]amino]acetamide
SMILESNC(=O)CNC1CC(=O)N(CCc2ccccc2)C1=O
InChIInChI=1S/C14H17N3O3/c15-12(18)9-16-11-8-13(19)17(14(11)20)7-6-10-4-2-1-3-5-10/h1-5,11,16H,6-9H2,(H2,15,18)
InChIKeyZPKKFOVMSUNTMS-UHFFFAOYSA-N
XLogP-0.57
TPSA92.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.31
LogP ≤ 5-0.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[[2,5-dioxo-1-(2-phenylethyl)pyrrolidin-3-yl]amino]acetamide?
The IUPAC name of 2-[[2,5-dioxo-1-(2-phenylethyl)pyrrolidin-3-yl]amino]acetamide (CID 3126833) is 2-[[2,5-dioxo-1-(2-phenylethyl)pyrrolidin-3-yl]amino]acetamide.
What is the SMILES notation for 2-[[2,5-dioxo-1-(2-phenylethyl)pyrrolidin-3-yl]amino]acetamide?
The canonical SMILES for 2-[[2,5-dioxo-1-(2-phenylethyl)pyrrolidin-3-yl]amino]acetamide is NC(=O)CNC1CC(=O)N(CCc2ccccc2)C1=O.
What is the InChIKey of 2-[[2,5-dioxo-1-(2-phenylethyl)pyrrolidin-3-yl]amino]acetamide?
The InChIKey is ZPKKFOVMSUNTMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O3/c15-12(18)9-16-11-8-13(19)17(14(11)20)7-6-10-4-2-1-3-5-10/h1-5,11,16H,6-9H2,(H2,15,18).
What are the key properties of 2-[[2,5-dioxo-1-(2-phenylethyl)pyrrolidin-3-yl]amino]acetamide?
2-[[2,5-dioxo-1-(2-phenylethyl)pyrrolidin-3-yl]amino]acetamide has a molecular weight of 275.31 g/mol, XLogP of -0.57, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2,5-dioxo-1-(2-phenylethyl)pyrrolidin-3-yl]amino]acetamide is sourced from PubChem (CID 3126833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).