3-(2,5-difluoroanilino)piperidine-2,6-dione

C11H10F2N2O2 — CID 170749830

IUPAC3-(2,5-difluoroanilino)piperidine-2,6-dione
SMILESO=C1CCC(Nc2cc(F)ccc2F)C(=O)N1
InChIInChI=1S/C11H10F2N2O2/c12-6-1-2-7(13)9(5-6)14-8-3-4-10(16)15-11(8)17/h1-2,5,8,14H,3-4H2,(H,15,16,17)
InChIKeyXGIOYNQQHYJKSE-UHFFFAOYSA-N
MW240.21 g/mol
LogP1.18
Rot. Bonds2

About 3-(2,5-difluoroanilino)piperidine-2,6-dione

3-(2,5-difluoroanilino)piperidine-2,6-dione (PubChem CID 170749830) has the molecular formula C11H10F2N2O2 and a molecular weight of 240.21 g/mol. Its IUPAC name is 3-(2,5-difluoroanilino)piperidine-2,6-dione.

Molecular Properties

Compound Name3-(2,5-difluoroanilino)piperidine-2,6-dione
PubChem CID170749830
Molecular FormulaC11H10F2N2O2
Molecular Weight240.21 g/mol
Exact Mass240.07
IUPAC Name3-(2,5-difluoroanilino)piperidine-2,6-dione
SMILESO=C1CCC(Nc2cc(F)ccc2F)C(=O)N1
InChIInChI=1S/C11H10F2N2O2/c12-6-1-2-7(13)9(5-6)14-8-3-4-10(16)15-11(8)17/h1-2,5,8,14H,3-4H2,(H,15,16,17)
InChIKeyXGIOYNQQHYJKSE-UHFFFAOYSA-N
XLogP1.18
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.21
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-(4-bromo-2-fluoroanilino)piperidine-2,6-dione
CID 172609781
ethane;ethene;3-(2-fluoroanilino)piperidine-2,6-dione;molecular hydrogen
CID 176683577
[5-[(2,6-dioxopiperidin-3-yl)amino]-2-fluorophenyl]carbamic acid
CID 154941373
3-(4-ethyl-2,5-difluoroanilino)piperidine-2,6-dione
CID 176683649
3-(5-chloro-2-fluoroanilino)pyrrolidine-2,5-dione
CID 43637896
3-(2-fluoro-4-piperidin-4-ylanilino)piperidine-2,6-dione
CID 156505691
3-(2-amino-4-bromo-5-fluoroanilino)piperidine-2,6-dione
CID 66110561
3-(5-chloro-2-methoxyanilino)piperidine-2,6-dione
CID 146573113
3-[2-fluoro-4-(1-methylpiperidin-4-yl)anilino]piperidine-2,6-dione
CID 166116987
3-[(2,5-difluorophenyl)methylamino]pyrrolidine-2,5-dione
CID 63795507
3-[(5-fluoro-3-pyridinyl)amino]piperidine-2,6-dione
CID 166472267
(3S)-3-(3-fluoro-2-piperidin-4-ylanilino)piperidine-2,6-dione;hydrochloride
CID 170728957

Frequently Asked Questions

What is the IUPAC name of 3-(2,5-difluoroanilino)piperidine-2,6-dione?
The IUPAC name of 3-(2,5-difluoroanilino)piperidine-2,6-dione (CID 170749830) is 3-(2,5-difluoroanilino)piperidine-2,6-dione.
What is the SMILES notation for 3-(2,5-difluoroanilino)piperidine-2,6-dione?
The canonical SMILES for 3-(2,5-difluoroanilino)piperidine-2,6-dione is O=C1CCC(Nc2cc(F)ccc2F)C(=O)N1.
What is the InChIKey of 3-(2,5-difluoroanilino)piperidine-2,6-dione?
The InChIKey is XGIOYNQQHYJKSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10F2N2O2/c12-6-1-2-7(13)9(5-6)14-8-3-4-10(16)15-11(8)17/h1-2,5,8,14H,3-4H2,(H,15,16,17).
What are the key properties of 3-(2,5-difluoroanilino)piperidine-2,6-dione?
3-(2,5-difluoroanilino)piperidine-2,6-dione has a molecular weight of 240.21 g/mol, XLogP of 1.18, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,5-difluoroanilino)piperidine-2,6-dione is sourced from PubChem (CID 170749830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).