1-(3-methyl-2,5-dioxopyrrolidin-1-yl)cyclopentane-1-carboxylic acid

C11H15NO4 — CID 61291210

IUPAC1-(3-methyl-2,5-dioxopyrrolidin-1-yl)cyclopentane-1-carboxylic acid
SMILESCC1CC(=O)N(C2(C(=O)O)CCCC2)C1=O
InChIInChI=1S/C11H15NO4/c1-7-6-8(13)12(9(7)14)11(10(15)16)4-2-3-5-11/h7H,2-6H2,1H3,(H,15,16)
InChIKeyOIJAGPRGZAWICA-UHFFFAOYSA-N
MW225.24 g/mol
LogP0.78
Rot. Bonds2

About 1-(3-methyl-2,5-dioxopyrrolidin-1-yl)cyclopentane-1-carboxylic acid

1-(3-methyl-2,5-dioxopyrrolidin-1-yl)cyclopentane-1-carboxylic acid (PubChem CID 61291210) has the molecular formula C11H15NO4 and a molecular weight of 225.24 g/mol. Its IUPAC name is 1-(3-methyl-2,5-dioxopyrrolidin-1-yl)cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name1-(3-methyl-2,5-dioxopyrrolidin-1-yl)cyclopentane-1-carboxylic acid
PubChem CID61291210
Molecular FormulaC11H15NO4
Molecular Weight225.24 g/mol
Exact Mass225.10
IUPAC Name1-(3-methyl-2,5-dioxopyrrolidin-1-yl)cyclopentane-1-carboxylic acid
SMILESCC1CC(=O)N(C2(C(=O)O)CCCC2)C1=O
InChIInChI=1S/C11H15NO4/c1-7-6-8(13)12(9(7)14)11(10(15)16)4-2-3-5-11/h7H,2-6H2,1H3,(H,15,16)
InChIKeyOIJAGPRGZAWICA-UHFFFAOYSA-N
XLogP0.78
TPSA74.68 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.24
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(2,5-Dioxopyrrolidin-1-yl)-2-methylpentanoic acid
CID 43645095
1-(2,5-Dioxopyrrolidin-1-yl)cyclohexane-1-carboxylic acid
CID 61289725
1-(2,5-Dioxopyrrolidin-1-yl)cyclopentane-1-carboxylic acid
CID 61291400
2-(2,5-Dioxopyrrolidin-1-yl)-2-methylhexanedioic acid
CID 68852461
2-Ethyl-5-oxopyrrolidine-1,2-dicarboxylic acid
CID 90789194
(2R)-2-ethyl-5-oxopyrrolidine-1,2-dicarboxylic acid
CID 91589083
2-(2,5-Dioxopyrrolidin-1-yl)-2-propylpentanoic acid
CID 114991230
2-(2,5-Dioxopyrrolidin-1-yl)-3-ethylhexanoic acid
CID 176165727
2-(2,5-Dioxopyrrolidin-1-yl)-2-methylheptanoic acid
CID 176165728
2-Methyl-2-(3-methyl-2,5-dioxo-3-propan-2-ylpyrrolidin-1-yl)pentanoic acid
CID 43645098
2-(1,3-Dioxo-2-azaspiro[4.4]nonan-2-yl)-2-methylpentanoic acid
CID 43645099
2-(3,3-Diethyl-2,5-dioxopyrrolidin-1-yl)-2-methylpentanoic acid
CID 43645101

Frequently Asked Questions

What is the IUPAC name of 1-(3-methyl-2,5-dioxopyrrolidin-1-yl)cyclopentane-1-carboxylic acid?
The IUPAC name of 1-(3-methyl-2,5-dioxopyrrolidin-1-yl)cyclopentane-1-carboxylic acid (CID 61291210) is 1-(3-methyl-2,5-dioxopyrrolidin-1-yl)cyclopentane-1-carboxylic acid.
What is the SMILES notation for 1-(3-methyl-2,5-dioxopyrrolidin-1-yl)cyclopentane-1-carboxylic acid?
The canonical SMILES for 1-(3-methyl-2,5-dioxopyrrolidin-1-yl)cyclopentane-1-carboxylic acid is CC1CC(=O)N(C2(C(=O)O)CCCC2)C1=O.
What is the InChIKey of 1-(3-methyl-2,5-dioxopyrrolidin-1-yl)cyclopentane-1-carboxylic acid?
The InChIKey is OIJAGPRGZAWICA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO4/c1-7-6-8(13)12(9(7)14)11(10(15)16)4-2-3-5-11/h7H,2-6H2,1H3,(H,15,16).
What are the key properties of 1-(3-methyl-2,5-dioxopyrrolidin-1-yl)cyclopentane-1-carboxylic acid?
1-(3-methyl-2,5-dioxopyrrolidin-1-yl)cyclopentane-1-carboxylic acid has a molecular weight of 225.24 g/mol, XLogP of 0.78, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methyl-2,5-dioxopyrrolidin-1-yl)cyclopentane-1-carboxylic acid is sourced from PubChem (CID 61291210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).