3-cyclopentyl-4-(4-methylphenyl)piperidine-2,6-dione

C17H21NO2 — CID 115927013

IUPAC3-cyclopentyl-4-(4-methylphenyl)piperidine-2,6-dione
SMILESCc1ccc(C2CC(=O)NC(=O)C2C2CCCC2)cc1
InChIInChI=1S/C17H21NO2/c1-11-6-8-12(9-7-11)14-10-15(19)18-17(20)16(14)13-4-2-3-5-13/h6-9,13-14,16H,2-5,10H2,1H3,(H,18,19,20)
InChIKeyBSVFRXGABUREGJ-UHFFFAOYSA-N
MW271.36 g/mol
LogP2.93
Rot. Bonds2

About 3-cyclopentyl-4-(4-methylphenyl)piperidine-2,6-dione

3-cyclopentyl-4-(4-methylphenyl)piperidine-2,6-dione (PubChem CID 115927013) has the molecular formula C17H21NO2 and a molecular weight of 271.36 g/mol. Its IUPAC name is 3-cyclopentyl-4-(4-methylphenyl)piperidine-2,6-dione.

Molecular Properties

Compound Name3-cyclopentyl-4-(4-methylphenyl)piperidine-2,6-dione
PubChem CID115927013
Molecular FormulaC17H21NO2
Molecular Weight271.36 g/mol
Exact Mass271.16
IUPAC Name3-cyclopentyl-4-(4-methylphenyl)piperidine-2,6-dione
SMILESCc1ccc(C2CC(=O)NC(=O)C2C2CCCC2)cc1
InChIInChI=1S/C17H21NO2/c1-11-6-8-12(9-7-11)14-10-15(19)18-17(20)16(14)13-4-2-3-5-13/h6-9,13-14,16H,2-5,10H2,1H3,(H,18,19,20)
InChIKeyBSVFRXGABUREGJ-UHFFFAOYSA-N
XLogP2.93
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-cyclopentyl-4-(4-fluorophenyl)piperidine-2,6-dione
CID 115926974
4-(3-bromo-4-chlorophenyl)-3-cyclopentylpiperidine-2,6-dione
CID 115926972
4-(4-bromo-5-methylthiophen-2-yl)-3-cyclopentylpiperidine-2,6-dione
CID 102845446
3-cyclopentylpyrrolidine-2,5-dione
CID 14918416
carbon dioxide;(4R,5S)-5-methyl-4-(4-methylphenyl)pyrrolidin-2-one
CID 157327473
(3S)-3-(4-methylphenyl)piperidine-2,6-dione
CID 94766924
3-cyclohexylpyrrolidine-2,5-dione
CID 12931268
4-cyclohexyl-3-(3-methylphenyl)piperidine-2,6-dione
CID 79424502
3-cyclopentyl-4-(3-cyclopropylimidazol-4-yl)piperidine-2,6-dione
CID 115926987
cyclopentyl (4R)-6-methyl-4-(4-methylphenyl)-2-oxo-3,4-dihydro-1H-pyridine-5-carboxylate
CID 7443773
cyclopentyl (4S)-6-methyl-4-(4-methylphenyl)-2-oxo-3,4-dihydro-1H-pyridine-5-carboxylate
CID 7443772
4-(4-cyclopropylphenyl)-3-ethylpiperidine-2,6-dione
CID 79977934

Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-4-(4-methylphenyl)piperidine-2,6-dione?
The IUPAC name of 3-cyclopentyl-4-(4-methylphenyl)piperidine-2,6-dione (CID 115927013) is 3-cyclopentyl-4-(4-methylphenyl)piperidine-2,6-dione.
What is the SMILES notation for 3-cyclopentyl-4-(4-methylphenyl)piperidine-2,6-dione?
The canonical SMILES for 3-cyclopentyl-4-(4-methylphenyl)piperidine-2,6-dione is Cc1ccc(C2CC(=O)NC(=O)C2C2CCCC2)cc1.
What is the InChIKey of 3-cyclopentyl-4-(4-methylphenyl)piperidine-2,6-dione?
The InChIKey is BSVFRXGABUREGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO2/c1-11-6-8-12(9-7-11)14-10-15(19)18-17(20)16(14)13-4-2-3-5-13/h6-9,13-14,16H,2-5,10H2,1H3,(H,18,19,20).
What are the key properties of 3-cyclopentyl-4-(4-methylphenyl)piperidine-2,6-dione?
3-cyclopentyl-4-(4-methylphenyl)piperidine-2,6-dione has a molecular weight of 271.36 g/mol, XLogP of 2.93, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-4-(4-methylphenyl)piperidine-2,6-dione is sourced from PubChem (CID 115927013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).