3-(4-aminophenyl)piperidine-2,6-dione;ethane

C15H24N2O2 — CID 177052461

IUPAC3-(4-aminophenyl)piperidine-2,6-dione;ethane
SMILESCC.CC.Nc1ccc(C2CCC(=O)NC2=O)cc1
InChIInChI=1S/C11H12N2O2.2C2H6/c12-8-3-1-7(2-4-8)9-5-6-10(14)13-11(9)15;2*1-2/h1-4,9H,5-6,12H2,(H,13,14,15);2*1-2H3
InChIKeyZTUXCMSLGHBRDV-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.84
Rot. Bonds1

About 3-(4-aminophenyl)piperidine-2,6-dione;ethane

3-(4-aminophenyl)piperidine-2,6-dione;ethane (PubChem CID 177052461) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 3-(4-aminophenyl)piperidine-2,6-dione;ethane.

Molecular Properties

Compound Name3-(4-aminophenyl)piperidine-2,6-dione;ethane
PubChem CID177052461
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name3-(4-aminophenyl)piperidine-2,6-dione;ethane
SMILESCC.CC.Nc1ccc(C2CCC(=O)NC2=O)cc1
InChIInChI=1S/C11H12N2O2.2C2H6/c12-8-3-1-7(2-4-8)9-5-6-10(14)13-11(9)15;2*1-2/h1-4,9H,5-6,12H2,(H,13,14,15);2*1-2H3
InChIKeyZTUXCMSLGHBRDV-UHFFFAOYSA-N
XLogP2.84
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-(4-aminophenyl)piperidine-2,6-dione;ethane?
The IUPAC name of 3-(4-aminophenyl)piperidine-2,6-dione;ethane (CID 177052461) is 3-(4-aminophenyl)piperidine-2,6-dione;ethane.
What is the SMILES notation for 3-(4-aminophenyl)piperidine-2,6-dione;ethane?
The canonical SMILES for 3-(4-aminophenyl)piperidine-2,6-dione;ethane is CC.CC.Nc1ccc(C2CCC(=O)NC2=O)cc1.
What is the InChIKey of 3-(4-aminophenyl)piperidine-2,6-dione;ethane?
The InChIKey is ZTUXCMSLGHBRDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O2.2C2H6/c12-8-3-1-7(2-4-8)9-5-6-10(14)13-11(9)15;2*1-2/h1-4,9H,5-6,12H2,(H,13,14,15);2*1-2H3.
What are the key properties of 3-(4-aminophenyl)piperidine-2,6-dione;ethane?
3-(4-aminophenyl)piperidine-2,6-dione;ethane has a molecular weight of 264.37 g/mol, XLogP of 2.84, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-aminophenyl)piperidine-2,6-dione;ethane is sourced from PubChem (CID 177052461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).