N-(cyclopentylcarbamoyl)-2-(2,5-dioxopyrrolidin-1-yl)acetamide

C12H17N3O4 — CID 2476904

IUPACN-(cyclopentylcarbamoyl)-2-(2,5-dioxopyrrolidin-1-yl)acetamide
SMILESO=C(CN1C(=O)CCC1=O)NC(=O)NC1CCCC1
InChIInChI=1S/C12H17N3O4/c16-9(7-15-10(17)5-6-11(15)18)14-12(19)13-8-3-1-2-4-8/h8H,1-7H2,(H2,13,14,16,19)
InChIKeyCWMLCGZBKLSPCB-UHFFFAOYSA-N
MW267.28 g/mol
LogP-0.10
Rot. Bonds3

About N-(cyclopentylcarbamoyl)-2-(2,5-dioxopyrrolidin-1-yl)acetamide

N-(cyclopentylcarbamoyl)-2-(2,5-dioxopyrrolidin-1-yl)acetamide (PubChem CID 2476904) has the molecular formula C12H17N3O4 and a molecular weight of 267.28 g/mol. Its IUPAC name is N-(cyclopentylcarbamoyl)-2-(2,5-dioxopyrrolidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(cyclopentylcarbamoyl)-2-(2,5-dioxopyrrolidin-1-yl)acetamide
PubChem CID2476904
Molecular FormulaC12H17N3O4
Molecular Weight267.28 g/mol
Exact Mass267.12
IUPAC NameN-(cyclopentylcarbamoyl)-2-(2,5-dioxopyrrolidin-1-yl)acetamide
SMILESO=C(CN1C(=O)CCC1=O)NC(=O)NC1CCCC1
InChIInChI=1S/C12H17N3O4/c16-9(7-15-10(17)5-6-11(15)18)14-12(19)13-8-3-1-2-4-8/h8H,1-7H2,(H2,13,14,16,19)
InChIKeyCWMLCGZBKLSPCB-UHFFFAOYSA-N
XLogP-0.10
TPSA95.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.28
LogP ≤ 5-0.10
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 N-(cyclopentylcarbamoyl)-2-(2,5-dioxopyrrolidin-1-yl)acetamide?
The IUPAC name of N-(cyclopentylcarbamoyl)-2-(2,5-dioxopyrrolidin-1-yl)acetamide (CID 2476904) is N-(cyclopentylcarbamoyl)-2-(2,5-dioxopyrrolidin-1-yl)acetamide.
What is the SMILES notation for N-(cyclopentylcarbamoyl)-2-(2,5-dioxopyrrolidin-1-yl)acetamide?
The canonical SMILES for N-(cyclopentylcarbamoyl)-2-(2,5-dioxopyrrolidin-1-yl)acetamide is O=C(CN1C(=O)CCC1=O)NC(=O)NC1CCCC1.
What is the InChIKey of N-(cyclopentylcarbamoyl)-2-(2,5-dioxopyrrolidin-1-yl)acetamide?
The InChIKey is CWMLCGZBKLSPCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O4/c16-9(7-15-10(17)5-6-11(15)18)14-12(19)13-8-3-1-2-4-8/h8H,1-7H2,(H2,13,14,16,19).
What are the key properties of N-(cyclopentylcarbamoyl)-2-(2,5-dioxopyrrolidin-1-yl)acetamide?
N-(cyclopentylcarbamoyl)-2-(2,5-dioxopyrrolidin-1-yl)acetamide has a molecular weight of 267.28 g/mol, XLogP of -0.10, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylcarbamoyl)-2-(2,5-dioxopyrrolidin-1-yl)acetamide is sourced from PubChem (CID 2476904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).