1-(3,5-dichloroanilino)pyrrolidine-2,5-dione

C10H8Cl2N2O2 — CID 174577235

IUPAC1-(3,5-dichloroanilino)pyrrolidine-2,5-dione
SMILESO=C1CCC(=O)N1Nc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C10H8Cl2N2O2/c11-6-3-7(12)5-8(4-6)13-14-9(15)1-2-10(14)16/h3-5,13H,1-2H2
InChIKeyMWYDTAGZEBHXDF-UHFFFAOYSA-N
MW259.09 g/mol
LogP2.47
Rot. Bonds2

About 1-(3,5-dichloroanilino)pyrrolidine-2,5-dione

1-(3,5-dichloroanilino)pyrrolidine-2,5-dione (PubChem CID 174577235) has the molecular formula C10H8Cl2N2O2 and a molecular weight of 259.09 g/mol. Its IUPAC name is 1-(3,5-dichloroanilino)pyrrolidine-2,5-dione.

Molecular Properties

Compound Name1-(3,5-dichloroanilino)pyrrolidine-2,5-dione
PubChem CID174577235
Molecular FormulaC10H8Cl2N2O2
Molecular Weight259.09 g/mol
Exact Mass258.00
IUPAC Name1-(3,5-dichloroanilino)pyrrolidine-2,5-dione
SMILESO=C1CCC(=O)N1Nc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C10H8Cl2N2O2/c11-6-3-7(12)5-8(4-6)13-14-9(15)1-2-10(14)16/h3-5,13H,1-2H2
InChIKeyMWYDTAGZEBHXDF-UHFFFAOYSA-N
XLogP2.47
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.09
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-(3-chloro-5-methylanilino)-3,4-dimethylpyrrole-2,5-dione
CID 138527412
N-(3,5-dichlorophenyl)-2-(2-oxopiperidin-1-yl)acetamide
CID 110689887
N-(3,5-dichlorophenyl)-2-oxo-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene-7-sulfonamide
CID 7527106
N-(3,5-dichlorophenyl)-2,5-dioxoimidazolidine-1-carboxamide
CID 139596644
(2Z)-2-[(3,5-dichloroanilino)methylidene]cyclohexan-1-one
CID 2188500
1-(3-chloroanilino)-3-ethyl-3-methylpyrrolidine-2,5-dione
CID 44585358
N-(3,5-dichlorophenyl)-5-oxo-1-phenylpyrrolidine-2-carboxamide
CID 110427657
sulfane;1,3,5-trichlorobenzene
CID 174951805
methane;tris(1,3,5-trichlorobenzene)
CID 175444750
1-(3,5-dichlorophenyl)pyrrolidin-3-one
CID 23052984
(2S)-N-(3,5-dichlorophenyl)-5-oxopyrrolidine-2-carboxamide
CID 26469933
1-[(3,5-dichlorophenyl)methyl]piperidin-4-one
CID 11959623

Frequently Asked Questions

What is the IUPAC name of 1-(3,5-dichloroanilino)pyrrolidine-2,5-dione?
The IUPAC name of 1-(3,5-dichloroanilino)pyrrolidine-2,5-dione (CID 174577235) is 1-(3,5-dichloroanilino)pyrrolidine-2,5-dione.
What is the SMILES notation for 1-(3,5-dichloroanilino)pyrrolidine-2,5-dione?
The canonical SMILES for 1-(3,5-dichloroanilino)pyrrolidine-2,5-dione is O=C1CCC(=O)N1Nc1cc(Cl)cc(Cl)c1.
What is the InChIKey of 1-(3,5-dichloroanilino)pyrrolidine-2,5-dione?
The InChIKey is MWYDTAGZEBHXDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8Cl2N2O2/c11-6-3-7(12)5-8(4-6)13-14-9(15)1-2-10(14)16/h3-5,13H,1-2H2.
What are the key properties of 1-(3,5-dichloroanilino)pyrrolidine-2,5-dione?
1-(3,5-dichloroanilino)pyrrolidine-2,5-dione has a molecular weight of 259.09 g/mol, XLogP of 2.47, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-dichloroanilino)pyrrolidine-2,5-dione is sourced from PubChem (CID 174577235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).