1-(2,6-dichlorophenyl)piperidine-2,6-dione

C11H9Cl2NO2 — CID 10879750

IUPAC1-(2,6-dichlorophenyl)piperidine-2,6-dione
SMILESO=C1CCCC(=O)N1c1c(Cl)cccc1Cl
InChIInChI=1S/C11H9Cl2NO2/c12-7-3-1-4-8(13)11(7)14-9(15)5-2-6-10(14)16/h1,3-4H,2,5-6H2
InChIKeyFPCPFCXCEMEIJN-UHFFFAOYSA-N
MW258.10 g/mol
LogP3.04
Rot. Bonds1

About 1-(2,6-dichlorophenyl)piperidine-2,6-dione

1-(2,6-dichlorophenyl)piperidine-2,6-dione (PubChem CID 10879750) has the molecular formula C11H9Cl2NO2 and a molecular weight of 258.10 g/mol. Its IUPAC name is 1-(2,6-dichlorophenyl)piperidine-2,6-dione.

Molecular Properties

Compound Name1-(2,6-dichlorophenyl)piperidine-2,6-dione
PubChem CID10879750
Molecular FormulaC11H9Cl2NO2
Molecular Weight258.10 g/mol
Exact Mass257.00
IUPAC Name1-(2,6-dichlorophenyl)piperidine-2,6-dione
SMILESO=C1CCCC(=O)N1c1c(Cl)cccc1Cl
InChIInChI=1S/C11H9Cl2NO2/c12-7-3-1-4-8(13)11(7)14-9(15)5-2-6-10(14)16/h1,3-4H,2,5-6H2
InChIKeyFPCPFCXCEMEIJN-UHFFFAOYSA-N
XLogP3.04
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.10
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-[2-chloro-6-(trifluoromethyl)phenyl]pyrrolidin-2-one
CID 166609152
9-(2,6-dichlorophenyl)-7,9-diazaspiro[4.5]decane-6,8,10-trione
CID 115948372
(1R,2R,6R,7R)-4-(2,6-dichlorophenyl)-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
CID 124837322
1-(3-fluorophenyl)piperidine-2,6-dione
CID 82077412
1-(4-amino-2,6-dichlorophenyl)pyrrolidine-2,5-dione;1-(4-aminophenyl)pyrrolidine-2,5-dione
CID 159530815
2-chloro-5-(2,6-dioxopiperidin-1-yl)benzoic acid
CID 50888852
3-chloro-2-piperidin-1-ylaniline;dihydrochloride
CID 53412034
1-(3-ethynylphenyl)azepane-2,7-dione
CID 60976686
1-[(2-chlorophenyl)-(2-oxopyrrolidin-1-yl)methyl]pyrrolidin-2-one
CID 102530474
1-[(3-chlorophenyl)methyl]piperidine-2,6-dione
CID 82129732
1-(3,5-dichloro-4-pyridinyl)-1,4-diazepane-2,7-dione
CID 134253432
(3aS)-9-chloro-2,3,3a,5-tetrahydro-1H-pyrrolo[1,2-a]quinoxalin-4-one
CID 124511746

Frequently Asked Questions

What is the IUPAC name of 1-(2,6-dichlorophenyl)piperidine-2,6-dione?
The IUPAC name of 1-(2,6-dichlorophenyl)piperidine-2,6-dione (CID 10879750) is 1-(2,6-dichlorophenyl)piperidine-2,6-dione.
What is the SMILES notation for 1-(2,6-dichlorophenyl)piperidine-2,6-dione?
The canonical SMILES for 1-(2,6-dichlorophenyl)piperidine-2,6-dione is O=C1CCCC(=O)N1c1c(Cl)cccc1Cl.
What is the InChIKey of 1-(2,6-dichlorophenyl)piperidine-2,6-dione?
The InChIKey is FPCPFCXCEMEIJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9Cl2NO2/c12-7-3-1-4-8(13)11(7)14-9(15)5-2-6-10(14)16/h1,3-4H,2,5-6H2.
What are the key properties of 1-(2,6-dichlorophenyl)piperidine-2,6-dione?
1-(2,6-dichlorophenyl)piperidine-2,6-dione has a molecular weight of 258.10 g/mol, XLogP of 3.04, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-dichlorophenyl)piperidine-2,6-dione is sourced from PubChem (CID 10879750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).