1-cyclopentyl-3-(pentylamino)pyrrolidine-2,5-dione

C14H24N2O2 — CID 43637430

IUPAC1-cyclopentyl-3-(pentylamino)pyrrolidine-2,5-dione
SMILESCCCCCNC1CC(=O)N(C2CCCC2)C1=O
InChIInChI=1S/C14H24N2O2/c1-2-3-6-9-15-12-10-13(17)16(14(12)18)11-7-4-5-8-11/h11-12,15H,2-10H2,1H3
InChIKeyFCSBVEGGWNAYNV-UHFFFAOYSA-N
MW252.36 g/mol
LogP1.84
Rot. Bonds6

About 1-cyclopentyl-3-(pentylamino)pyrrolidine-2,5-dione

1-cyclopentyl-3-(pentylamino)pyrrolidine-2,5-dione (PubChem CID 43637430) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is 1-cyclopentyl-3-(pentylamino)pyrrolidine-2,5-dione.

Molecular Properties

Compound Name1-cyclopentyl-3-(pentylamino)pyrrolidine-2,5-dione
PubChem CID43637430
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC Name1-cyclopentyl-3-(pentylamino)pyrrolidine-2,5-dione
SMILESCCCCCNC1CC(=O)N(C2CCCC2)C1=O
InChIInChI=1S/C14H24N2O2/c1-2-3-6-9-15-12-10-13(17)16(14(12)18)11-7-4-5-8-11/h11-12,15H,2-10H2,1H3
InChIKeyFCSBVEGGWNAYNV-UHFFFAOYSA-N
XLogP1.84
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-3-(pentylamino)pyrrolidine-2,5-dione?
The IUPAC name of 1-cyclopentyl-3-(pentylamino)pyrrolidine-2,5-dione (CID 43637430) is 1-cyclopentyl-3-(pentylamino)pyrrolidine-2,5-dione.
What is the SMILES notation for 1-cyclopentyl-3-(pentylamino)pyrrolidine-2,5-dione?
The canonical SMILES for 1-cyclopentyl-3-(pentylamino)pyrrolidine-2,5-dione is CCCCCNC1CC(=O)N(C2CCCC2)C1=O.
What is the InChIKey of 1-cyclopentyl-3-(pentylamino)pyrrolidine-2,5-dione?
The InChIKey is FCSBVEGGWNAYNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-2-3-6-9-15-12-10-13(17)16(14(12)18)11-7-4-5-8-11/h11-12,15H,2-10H2,1H3.
What are the key properties of 1-cyclopentyl-3-(pentylamino)pyrrolidine-2,5-dione?
1-cyclopentyl-3-(pentylamino)pyrrolidine-2,5-dione has a molecular weight of 252.36 g/mol, XLogP of 1.84, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-3-(pentylamino)pyrrolidine-2,5-dione is sourced from PubChem (CID 43637430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).