1-ethyl-3-[(3-methylcyclopentyl)amino]pyrrolidine-2,5-dione

C12H20N2O2 — CID 114545469

IUPAC1-ethyl-3-[(3-methylcyclopentyl)amino]pyrrolidine-2,5-dione
SMILESCCN1C(=O)CC(NC2CCC(C)C2)C1=O
InChIInChI=1S/C12H20N2O2/c1-3-14-11(15)7-10(12(14)16)13-9-5-4-8(2)6-9/h8-10,13H,3-7H2,1-2H3
InChIKeyVOIRWERBWVCWPW-UHFFFAOYSA-N
MW224.30 g/mol
LogP0.91
Rot. Bonds3

About 1-ethyl-3-[(3-methylcyclopentyl)amino]pyrrolidine-2,5-dione

1-ethyl-3-[(3-methylcyclopentyl)amino]pyrrolidine-2,5-dione (PubChem CID 114545469) has the molecular formula C12H20N2O2 and a molecular weight of 224.30 g/mol. Its IUPAC name is 1-ethyl-3-[(3-methylcyclopentyl)amino]pyrrolidine-2,5-dione.

Molecular Properties

Compound Name1-ethyl-3-[(3-methylcyclopentyl)amino]pyrrolidine-2,5-dione
PubChem CID114545469
Molecular FormulaC12H20N2O2
Molecular Weight224.30 g/mol
Exact Mass224.15
IUPAC Name1-ethyl-3-[(3-methylcyclopentyl)amino]pyrrolidine-2,5-dione
SMILESCCN1C(=O)CC(NC2CCC(C)C2)C1=O
InChIInChI=1S/C12H20N2O2/c1-3-14-11(15)7-10(12(14)16)13-9-5-4-8(2)6-9/h8-10,13H,3-7H2,1-2H3
InChIKeyVOIRWERBWVCWPW-UHFFFAOYSA-N
XLogP0.91
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 50.91
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

3-[(3-methylcyclopentyl)amino]-1-propan-2-ylpyrrolidine-2,5-dione
CID 114545472
1-ethyl-3-(oxolan-3-ylamino)pyrrolidine-2,5-dione
CID 80713003
1-ethyl-3-(3-tricyclo[3.2.1.02,4]octanylamino)pyrrolidine-2,5-dione
CID 114095808
1-ethyl-3-[(1-methyl-6-oxopiperidin-3-yl)amino]pyrrolidine-2,5-dione
CID 64656132
3-[(1-ethylpiperidin-4-yl)amino]-1-propylpyrrolidine-2,5-dione
CID 54917477
1-ethyl-3-(methylamino)pyrrolidine-2,5-dione
CID 43636114
3-(cyclooctylamino)-1-propylpyrrolidine-2,5-dione
CID 43636456
3-[(2-methylcyclopropyl)amino]-1-propylpyrrolidine-2,5-dione
CID 62397716
3-[(3-ethoxycyclobutyl)amino]-1-propylpyrrolidine-2,5-dione
CID 114118968
3-[(3,4-dimethylcyclohexyl)amino]-1-pentan-3-ylpyrrolidine-2,5-dione
CID 64742275
1-ethyl-3-[(3-methoxy-2,2-dimethylcyclobutyl)amino]pyrrolidine-2,5-dione
CID 114118967
3-(2,2-dimethylpropylamino)-1-ethylpyrrolidine-2,5-dione
CID 61168805

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-[(3-methylcyclopentyl)amino]pyrrolidine-2,5-dione?
The IUPAC name of 1-ethyl-3-[(3-methylcyclopentyl)amino]pyrrolidine-2,5-dione (CID 114545469) is 1-ethyl-3-[(3-methylcyclopentyl)amino]pyrrolidine-2,5-dione.
What is the SMILES notation for 1-ethyl-3-[(3-methylcyclopentyl)amino]pyrrolidine-2,5-dione?
The canonical SMILES for 1-ethyl-3-[(3-methylcyclopentyl)amino]pyrrolidine-2,5-dione is CCN1C(=O)CC(NC2CCC(C)C2)C1=O.
What is the InChIKey of 1-ethyl-3-[(3-methylcyclopentyl)amino]pyrrolidine-2,5-dione?
The InChIKey is VOIRWERBWVCWPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2/c1-3-14-11(15)7-10(12(14)16)13-9-5-4-8(2)6-9/h8-10,13H,3-7H2,1-2H3.
What are the key properties of 1-ethyl-3-[(3-methylcyclopentyl)amino]pyrrolidine-2,5-dione?
1-ethyl-3-[(3-methylcyclopentyl)amino]pyrrolidine-2,5-dione has a molecular weight of 224.30 g/mol, XLogP of 0.91, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-[(3-methylcyclopentyl)amino]pyrrolidine-2,5-dione is sourced from PubChem (CID 114545469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).