1-(2-ethylcyclopentyl)pyrrole-2,5-dione

C11H15NO2 — CID 18439063

IUPAC1-(2-ethylcyclopentyl)pyrrole-2,5-dione
SMILESCCC1CCCC1N1C(=O)C=CC1=O
InChIInChI=1S/C11H15NO2/c1-2-8-4-3-5-9(8)12-10(13)6-7-11(12)14/h6-9H,2-5H2,1H3
InChIKeyOCVAQIMHMZTZKK-UHFFFAOYSA-N
MW193.25 g/mol
LogP1.49
Rot. Bonds2

About 1-(2-ethylcyclopentyl)pyrrole-2,5-dione

1-(2-ethylcyclopentyl)pyrrole-2,5-dione (PubChem CID 18439063) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is 1-(2-ethylcyclopentyl)pyrrole-2,5-dione.

Molecular Properties

Compound Name1-(2-ethylcyclopentyl)pyrrole-2,5-dione
PubChem CID18439063
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC Name1-(2-ethylcyclopentyl)pyrrole-2,5-dione
SMILESCCC1CCCC1N1C(=O)C=CC1=O
InChIInChI=1S/C11H15NO2/c1-2-8-4-3-5-9(8)12-10(13)6-7-11(12)14/h6-9H,2-5H2,1H3
InChIKeyOCVAQIMHMZTZKK-UHFFFAOYSA-N
XLogP1.49
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-cyclohexylmethylmaleimide
CID 18361637
1-(2-Acetylcyclopentyl)pyrrole-2,5-dione
CID 18439055
1-(2-Methylcyclopentyl)pyrrole-2,5-dione
CID 18439076
1-(2-Propanoylcyclopentyl)pyrrole-2,5-dione
CID 18439114
1-(2-Tert-butylcyclopentyl)pyrrole-2,5-dione
CID 18439118
1-(2,3-Diethylcyclopentyl)pyrrole-2,5-dione
CID 18439120
1-(2,3-Dimethylcyclopentyl)pyrrole-2,5-dione
CID 18439126
1-(2,3-Dibutylcyclopentyl)pyrrole-2,5-dione
CID 18439128
1-(2,3-Dipropylcyclopentyl)pyrrole-2,5-dione
CID 18439130
1-(2,3-Ditert-butylcyclopentyl)pyrrole-2,5-dione
CID 18439132
1-(2,3,4-Triethylcyclopentyl)pyrrole-2,5-dione
CID 18439134
1-(2,3,4-Trimethylcyclopentyl)pyrrole-2,5-dione
CID 18439140

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethylcyclopentyl)pyrrole-2,5-dione?
The IUPAC name of 1-(2-ethylcyclopentyl)pyrrole-2,5-dione (CID 18439063) is 1-(2-ethylcyclopentyl)pyrrole-2,5-dione.
What is the SMILES notation for 1-(2-ethylcyclopentyl)pyrrole-2,5-dione?
The canonical SMILES for 1-(2-ethylcyclopentyl)pyrrole-2,5-dione is CCC1CCCC1N1C(=O)C=CC1=O.
What is the InChIKey of 1-(2-ethylcyclopentyl)pyrrole-2,5-dione?
The InChIKey is OCVAQIMHMZTZKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2/c1-2-8-4-3-5-9(8)12-10(13)6-7-11(12)14/h6-9H,2-5H2,1H3.
What are the key properties of 1-(2-ethylcyclopentyl)pyrrole-2,5-dione?
1-(2-ethylcyclopentyl)pyrrole-2,5-dione has a molecular weight of 193.25 g/mol, XLogP of 1.49, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethylcyclopentyl)pyrrole-2,5-dione is sourced from PubChem (CID 18439063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).