4-methyl-1-(4-methylphenyl)piperidine-2,6-dione

C13H15NO2 — CID 2732323

IUPAC4-methyl-1-(4-methylphenyl)piperidine-2,6-dione
SMILESCc1ccc(N2C(=O)CC(C)CC2=O)cc1
InChIInChI=1S/C13H15NO2/c1-9-3-5-11(6-4-9)14-12(15)7-10(2)8-13(14)16/h3-6,10H,7-8H2,1-2H3
InChIKeyDXPWZGIZWPBUSB-UHFFFAOYSA-N
MW217.27 g/mol
LogP2.28
Rot. Bonds1

About 4-methyl-1-(4-methylphenyl)piperidine-2,6-dione

4-methyl-1-(4-methylphenyl)piperidine-2,6-dione (PubChem CID 2732323) has the molecular formula C13H15NO2 and a molecular weight of 217.27 g/mol. Its IUPAC name is 4-methyl-1-(4-methylphenyl)piperidine-2,6-dione.

Molecular Properties

Compound Name4-methyl-1-(4-methylphenyl)piperidine-2,6-dione
PubChem CID2732323
Molecular FormulaC13H15NO2
Molecular Weight217.27 g/mol
Exact Mass217.11
IUPAC Name4-methyl-1-(4-methylphenyl)piperidine-2,6-dione
SMILESCc1ccc(N2C(=O)CC(C)CC2=O)cc1
InChIInChI=1S/C13H15NO2/c1-9-3-5-11(6-4-9)14-12(15)7-10(2)8-13(14)16/h3-6,10H,7-8H2,1-2H3
InChIKeyDXPWZGIZWPBUSB-UHFFFAOYSA-N
XLogP2.28
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 52.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-(4-methylphenyl)piperidine-2,6-dione?
The IUPAC name of 4-methyl-1-(4-methylphenyl)piperidine-2,6-dione (CID 2732323) is 4-methyl-1-(4-methylphenyl)piperidine-2,6-dione.
What is the SMILES notation for 4-methyl-1-(4-methylphenyl)piperidine-2,6-dione?
The canonical SMILES for 4-methyl-1-(4-methylphenyl)piperidine-2,6-dione is Cc1ccc(N2C(=O)CC(C)CC2=O)cc1.
What is the InChIKey of 4-methyl-1-(4-methylphenyl)piperidine-2,6-dione?
The InChIKey is DXPWZGIZWPBUSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO2/c1-9-3-5-11(6-4-9)14-12(15)7-10(2)8-13(14)16/h3-6,10H,7-8H2,1-2H3.
What are the key properties of 4-methyl-1-(4-methylphenyl)piperidine-2,6-dione?
4-methyl-1-(4-methylphenyl)piperidine-2,6-dione has a molecular weight of 217.27 g/mol, XLogP of 2.28, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-(4-methylphenyl)piperidine-2,6-dione is sourced from PubChem (CID 2732323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).