3-[4-(piperidine-1-carbonyl)piperidin-1-yl]pyrrolidine-2,5-dione

C15H23N3O3 — CID 2979075

IUPAC3-[4-(piperidine-1-carbonyl)piperidin-1-yl]pyrrolidine-2,5-dione
SMILESO=C1CC(N2CCC(C(=O)N3CCCCC3)CC2)C(=O)N1
InChIInChI=1S/C15H23N3O3/c19-13-10-12(14(20)16-13)17-8-4-11(5-9-17)15(21)18-6-2-1-3-7-18/h11-12H,1-10H2,(H,16,19,20)
InChIKeyCSXDMJLTRAAJLN-UHFFFAOYSA-N
MW293.37 g/mol
LogP0.13
Rot. Bonds2

About 3-[4-(piperidine-1-carbonyl)piperidin-1-yl]pyrrolidine-2,5-dione

3-[4-(piperidine-1-carbonyl)piperidin-1-yl]pyrrolidine-2,5-dione (PubChem CID 2979075) has the molecular formula C15H23N3O3 and a molecular weight of 293.37 g/mol. Its IUPAC name is 3-[4-(piperidine-1-carbonyl)piperidin-1-yl]pyrrolidine-2,5-dione.

Molecular Properties

Compound Name3-[4-(piperidine-1-carbonyl)piperidin-1-yl]pyrrolidine-2,5-dione
PubChem CID2979075
Molecular FormulaC15H23N3O3
Molecular Weight293.37 g/mol
Exact Mass293.17
IUPAC Name3-[4-(piperidine-1-carbonyl)piperidin-1-yl]pyrrolidine-2,5-dione
SMILESO=C1CC(N2CCC(C(=O)N3CCCCC3)CC2)C(=O)N1
InChIInChI=1S/C15H23N3O3/c19-13-10-12(14(20)16-13)17-8-4-11(5-9-17)15(21)18-6-2-1-3-7-18/h11-12H,1-10H2,(H,16,19,20)
InChIKeyCSXDMJLTRAAJLN-UHFFFAOYSA-N
XLogP0.13
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 50.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-[4-(piperidine-1-carbonyl)piperidin-1-yl]pyrrolidine-2,5-dione?
The IUPAC name of 3-[4-(piperidine-1-carbonyl)piperidin-1-yl]pyrrolidine-2,5-dione (CID 2979075) is 3-[4-(piperidine-1-carbonyl)piperidin-1-yl]pyrrolidine-2,5-dione.
What is the SMILES notation for 3-[4-(piperidine-1-carbonyl)piperidin-1-yl]pyrrolidine-2,5-dione?
The canonical SMILES for 3-[4-(piperidine-1-carbonyl)piperidin-1-yl]pyrrolidine-2,5-dione is O=C1CC(N2CCC(C(=O)N3CCCCC3)CC2)C(=O)N1.
What is the InChIKey of 3-[4-(piperidine-1-carbonyl)piperidin-1-yl]pyrrolidine-2,5-dione?
The InChIKey is CSXDMJLTRAAJLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O3/c19-13-10-12(14(20)16-13)17-8-4-11(5-9-17)15(21)18-6-2-1-3-7-18/h11-12H,1-10H2,(H,16,19,20).
What are the key properties of 3-[4-(piperidine-1-carbonyl)piperidin-1-yl]pyrrolidine-2,5-dione?
3-[4-(piperidine-1-carbonyl)piperidin-1-yl]pyrrolidine-2,5-dione has a molecular weight of 293.37 g/mol, XLogP of 0.13, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(piperidine-1-carbonyl)piperidin-1-yl]pyrrolidine-2,5-dione is sourced from PubChem (CID 2979075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).