ethane;ethene;3-(2-fluoroanilino)piperidine-2,6-dione;molecular hydrogen

C15H25FN2O2 — CID 176683577

IUPACethane;ethene;3-(2-fluoroanilino)piperidine-2,6-dione;molecular hydrogen
SMILESC=C.CC.O=C1CCC(Nc2ccccc2F)C(=O)N1.[H][H].[H][H]
InChIInChI=1S/C11H11FN2O2.C2H6.C2H4.2H2/c12-7-3-1-2-4-8(7)13-9-5-6-10(15)14-11(9)16;2*1-2;;/h1-4,9,13H,5-6H2,(H,14,15,16);1-2H3;1-2H2;2*1H
InChIKeyBKADMGODJMHTAY-UHFFFAOYSA-N
MW284.38 g/mol
LogP3.36
Rot. Bonds2

About ethane;ethene;3-(2-fluoroanilino)piperidine-2,6-dione;molecular hydrogen

ethane;ethene;3-(2-fluoroanilino)piperidine-2,6-dione;molecular hydrogen (PubChem CID 176683577) has the molecular formula C15H25FN2O2 and a molecular weight of 284.38 g/mol. Its IUPAC name is ethane;ethene;3-(2-fluoroanilino)piperidine-2,6-dione;molecular hydrogen.

Molecular Properties

Compound Nameethane;ethene;3-(2-fluoroanilino)piperidine-2,6-dione;molecular hydrogen
PubChem CID176683577
Molecular FormulaC15H25FN2O2
Molecular Weight284.38 g/mol
Exact Mass284.19
IUPAC Nameethane;ethene;3-(2-fluoroanilino)piperidine-2,6-dione;molecular hydrogen
SMILESC=C.CC.O=C1CCC(Nc2ccccc2F)C(=O)N1.[H][H].[H][H]
InChIInChI=1S/C11H11FN2O2.C2H6.C2H4.2H2/c12-7-3-1-2-4-8(7)13-9-5-6-10(15)14-11(9)16;2*1-2;;/h1-4,9,13H,5-6H2,(H,14,15,16);1-2H3;1-2H2;2*1H
InChIKeyBKADMGODJMHTAY-UHFFFAOYSA-N
XLogP3.36
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.38
LogP ≤ 53.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-(2,5-difluoroanilino)piperidine-2,6-dione
CID 170749830
(3S)-3-(3-fluoro-2-piperidin-4-ylanilino)piperidine-2,6-dione;hydrochloride
CID 170728957
3-(4-bromo-2-fluoroanilino)piperidine-2,6-dione
CID 172609781
3-[2-(difluoromethoxy)anilino]piperidine-2,6-dione
CID 146573025
3-(4-ethyl-2,5-difluoroanilino)piperidine-2,6-dione
CID 176683649
3-(2-fluoro-4-piperidin-4-ylanilino)piperidine-2,6-dione
CID 156505691
3-[2-fluoro-4-(1-methylpiperidin-4-yl)anilino]piperidine-2,6-dione
CID 166116987
3-(2-piperazin-1-ylanilino)piperidine-2,6-dione
CID 168896759
3-(3-fluoro-2-methylanilino)-1,3,4,5-tetrahydro-1-benzazepin-2-one
CID 103313252
3-[(2-amino-3-pyridinyl)amino]piperidine-2,6-dione
CID 104540520
N-(2-fluorophenyl)-2,6-dioxopiperidine-3-carboxamide
CID 138460839
3-[[(2-fluorophenyl)-hydroxymethyl]amino]piperidine-2,6-dione
CID 177240512

Frequently Asked Questions

What is the IUPAC name of ethane;ethene;3-(2-fluoroanilino)piperidine-2,6-dione;molecular hydrogen?
The IUPAC name of ethane;ethene;3-(2-fluoroanilino)piperidine-2,6-dione;molecular hydrogen (CID 176683577) is ethane;ethene;3-(2-fluoroanilino)piperidine-2,6-dione;molecular hydrogen.
What is the SMILES notation for ethane;ethene;3-(2-fluoroanilino)piperidine-2,6-dione;molecular hydrogen?
The canonical SMILES for ethane;ethene;3-(2-fluoroanilino)piperidine-2,6-dione;molecular hydrogen is C=C.CC.O=C1CCC(Nc2ccccc2F)C(=O)N1.[H][H].[H][H].
What is the InChIKey of ethane;ethene;3-(2-fluoroanilino)piperidine-2,6-dione;molecular hydrogen?
The InChIKey is BKADMGODJMHTAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11FN2O2.C2H6.C2H4.2H2/c12-7-3-1-2-4-8(7)13-9-5-6-10(15)14-11(9)16;2*1-2;;/h1-4,9,13H,5-6H2,(H,14,15,16);1-2H3;1-2H2;2*1H.
What are the key properties of ethane;ethene;3-(2-fluoroanilino)piperidine-2,6-dione;molecular hydrogen?
ethane;ethene;3-(2-fluoroanilino)piperidine-2,6-dione;molecular hydrogen has a molecular weight of 284.38 g/mol, XLogP of 3.36, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;ethene;3-(2-fluoroanilino)piperidine-2,6-dione;molecular hydrogen is sourced from PubChem (CID 176683577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).