1-(3-aminocyclopentyl)-3-methylpyrrolidine-2,5-dione

C10H16N2O2 — CID 130624170

IUPAC1-(3-aminocyclopentyl)-3-methylpyrrolidine-2,5-dione
SMILESCC1CC(=O)N(C2CCC(N)C2)C1=O
InChIInChI=1S/C10H16N2O2/c1-6-4-9(13)12(10(6)14)8-3-2-7(11)5-8/h6-8H,2-5,11H2,1H3
InChIKeyPUCXWVVQGCPEDX-UHFFFAOYSA-N
MW196.25 g/mol
LogP0.26
Rot. Bonds1

About 1-(3-aminocyclopentyl)-3-methylpyrrolidine-2,5-dione

1-(3-aminocyclopentyl)-3-methylpyrrolidine-2,5-dione (PubChem CID 130624170) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is 1-(3-aminocyclopentyl)-3-methylpyrrolidine-2,5-dione.

Molecular Properties

Compound Name1-(3-aminocyclopentyl)-3-methylpyrrolidine-2,5-dione
PubChem CID130624170
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC Name1-(3-aminocyclopentyl)-3-methylpyrrolidine-2,5-dione
SMILESCC1CC(=O)N(C2CCC(N)C2)C1=O
InChIInChI=1S/C10H16N2O2/c1-6-4-9(13)12(10(6)14)8-3-2-7(11)5-8/h6-8H,2-5,11H2,1H3
InChIKeyPUCXWVVQGCPEDX-UHFFFAOYSA-N
XLogP0.26
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 50.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(3-aminocyclopentyl)-3-methylpyrrolidine-2,5-dione?
The IUPAC name of 1-(3-aminocyclopentyl)-3-methylpyrrolidine-2,5-dione (CID 130624170) is 1-(3-aminocyclopentyl)-3-methylpyrrolidine-2,5-dione.
What is the SMILES notation for 1-(3-aminocyclopentyl)-3-methylpyrrolidine-2,5-dione?
The canonical SMILES for 1-(3-aminocyclopentyl)-3-methylpyrrolidine-2,5-dione is CC1CC(=O)N(C2CCC(N)C2)C1=O.
What is the InChIKey of 1-(3-aminocyclopentyl)-3-methylpyrrolidine-2,5-dione?
The InChIKey is PUCXWVVQGCPEDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2/c1-6-4-9(13)12(10(6)14)8-3-2-7(11)5-8/h6-8H,2-5,11H2,1H3.
What are the key properties of 1-(3-aminocyclopentyl)-3-methylpyrrolidine-2,5-dione?
1-(3-aminocyclopentyl)-3-methylpyrrolidine-2,5-dione has a molecular weight of 196.25 g/mol, XLogP of 0.26, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-aminocyclopentyl)-3-methylpyrrolidine-2,5-dione is sourced from PubChem (CID 130624170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).