piperidine-2,6-dione;4-propan-2-ylisoindole-1,3-dione

C16H18N2O4 — CID 155707467

IUPACpiperidine-2,6-dione;4-propan-2-ylisoindole-1,3-dione
SMILESCC(C)c1cccc2c1C(=O)NC2=O.O=C1CCCC(=O)N1
InChIInChI=1S/C11H11NO2.C5H7NO2/c1-6(2)7-4-3-5-8-9(7)11(14)12-10(8)13;7-4-2-1-3-5(8)6-4/h3-6H,1-2H3,(H,12,13,14);1-3H2,(H,6,7,8)
InChIKeyBFDRVSWDYQBOFV-UHFFFAOYSA-N
MW302.33 g/mol
LogP1.51
Rot. Bonds1

About piperidine-2,6-dione;4-propan-2-ylisoindole-1,3-dione

piperidine-2,6-dione;4-propan-2-ylisoindole-1,3-dione (PubChem CID 155707467) has the molecular formula C16H18N2O4 and a molecular weight of 302.33 g/mol. Its IUPAC name is piperidine-2,6-dione;4-propan-2-ylisoindole-1,3-dione.

Molecular Properties

Compound Namepiperidine-2,6-dione;4-propan-2-ylisoindole-1,3-dione
PubChem CID155707467
Molecular FormulaC16H18N2O4
Molecular Weight302.33 g/mol
Exact Mass302.13
IUPAC Namepiperidine-2,6-dione;4-propan-2-ylisoindole-1,3-dione
SMILESCC(C)c1cccc2c1C(=O)NC2=O.O=C1CCCC(=O)N1
InChIInChI=1S/C11H11NO2.C5H7NO2/c1-6(2)7-4-3-5-8-9(7)11(14)12-10(8)13;7-4-2-1-3-5(8)6-4/h3-6H,1-2H3,(H,12,13,14);1-3H2,(H,6,7,8)
InChIKeyBFDRVSWDYQBOFV-UHFFFAOYSA-N
XLogP1.51
TPSA92.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.33
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze piperidine-2,6-dione;4-propan-2-ylisoindole-1,3-dione with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

piperidine-2,6-dione;4-propan-2-yl-2,3-dihydroisoindol-1-one
CID 156794502
4,7-di(propan-2-yl)isoindole-1,3-dione
CID 152870572
2-(2,7-dioxoazepan-3-yl)-4-propan-2-ylisoindole-1,3-dione;molecular hydrogen
CID 142590623
4-[1-(3-hydroxyphenyl)ethyl]isoindole-1,3-dione
CID 22111154
4-propan-2-yloxyisoindole-1,3-dione
CID 22997019
N-[(1,3-dioxoisoindol-4-yl)methyl]-N-[2,6-di(propan-2-yl)phenyl]methanesulfonamide
CID 70493560
4-(1,3-dioxoisoindol-4-yl)sulfanylisoindole-1,3-dione
CID 21403125
4-(cyclobuten-1-yl)isoindole-1,3-dione
CID 158098721
4-(1-phenylhexyl)isoindole-1,3-dione
CID 67700217
4-[(3S)-2,6-dioxopiperidin-3-yl]isoindole-1,3-dione
CID 97303764
4-(1-hydroxycyclohexyl)isoindole-1,3-dione
CID 166130522
4-(methyldisulfanyl)isoindole-1,3-dione
CID 87696056

Frequently Asked Questions

What is the IUPAC name of piperidine-2,6-dione;4-propan-2-ylisoindole-1,3-dione?
The IUPAC name of piperidine-2,6-dione;4-propan-2-ylisoindole-1,3-dione (CID 155707467) is piperidine-2,6-dione;4-propan-2-ylisoindole-1,3-dione.
What is the SMILES notation for piperidine-2,6-dione;4-propan-2-ylisoindole-1,3-dione?
The canonical SMILES for piperidine-2,6-dione;4-propan-2-ylisoindole-1,3-dione is CC(C)c1cccc2c1C(=O)NC2=O.O=C1CCCC(=O)N1.
What is the InChIKey of piperidine-2,6-dione;4-propan-2-ylisoindole-1,3-dione?
The InChIKey is BFDRVSWDYQBOFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO2.C5H7NO2/c1-6(2)7-4-3-5-8-9(7)11(14)12-10(8)13;7-4-2-1-3-5(8)6-4/h3-6H,1-2H3,(H,12,13,14);1-3H2,(H,6,7,8).
What are the key properties of piperidine-2,6-dione;4-propan-2-ylisoindole-1,3-dione?
piperidine-2,6-dione;4-propan-2-ylisoindole-1,3-dione has a molecular weight of 302.33 g/mol, XLogP of 1.51, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for piperidine-2,6-dione;4-propan-2-ylisoindole-1,3-dione is sourced from PubChem (CID 155707467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).