ethane;1-ethyl-4-hydroxy-4-methylpiperidine-2,6-dione

C10H19NO3 — CID 143012313

IUPACethane;1-ethyl-4-hydroxy-4-methylpiperidine-2,6-dione
SMILESCC.CCN1C(=O)CC(C)(O)CC1=O
InChIInChI=1S/C8H13NO3.C2H6/c1-3-9-6(10)4-8(2,12)5-7(9)11;1-2/h12H,3-5H2,1-2H3;1-2H3
InChIKeyRYLDHYLALRHUGA-UHFFFAOYSA-N
MW201.27 g/mol
LogP0.93
Rot. Bonds1

About ethane;1-ethyl-4-hydroxy-4-methylpiperidine-2,6-dione

ethane;1-ethyl-4-hydroxy-4-methylpiperidine-2,6-dione (PubChem CID 143012313) has the molecular formula C10H19NO3 and a molecular weight of 201.27 g/mol. Its IUPAC name is ethane;1-ethyl-4-hydroxy-4-methylpiperidine-2,6-dione.

Molecular Properties

Compound Nameethane;1-ethyl-4-hydroxy-4-methylpiperidine-2,6-dione
PubChem CID143012313
Molecular FormulaC10H19NO3
Molecular Weight201.27 g/mol
Exact Mass201.14
IUPAC Nameethane;1-ethyl-4-hydroxy-4-methylpiperidine-2,6-dione
SMILESCC.CCN1C(=O)CC(C)(O)CC1=O
InChIInChI=1S/C8H13NO3.C2H6/c1-3-9-6(10)4-8(2,12)5-7(9)11;1-2/h12H,3-5H2,1-2H3;1-2H3
InChIKeyRYLDHYLALRHUGA-UHFFFAOYSA-N
XLogP0.93
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 50.93
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

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CID 19814204
3-ethyl-3,9-diazaspiro[5.5]undecane-2,4-dione
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3-ethyl-6,6-dimethyl-1,3-oxazinane-2,4-dione
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ethene;1-ethylpyrrolidine-2,5-dione
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6,7-diamino-1-ethyl-4,4-dimethyl-3H-quinolin-2-one
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4,4-difluoro-1-(methylsulfanylmethyl)piperidine-2,6-dione
CID 162551678
ethane;2-ethyl-5,5-dimethyl-1,2-oxazolidin-3-one
CID 177197066
4-ethyl-1,4-dimethylpiperidine-2,6-dione
CID 544425
ethane;3-ethyl-1-methylimidazolidine-2,4-dione
CID 142101907
1-ethyl-3,3-dimethylpiperazine-2,6-dione
CID 66067687

Frequently Asked Questions

What is the IUPAC name of ethane;1-ethyl-4-hydroxy-4-methylpiperidine-2,6-dione?
The IUPAC name of ethane;1-ethyl-4-hydroxy-4-methylpiperidine-2,6-dione (CID 143012313) is ethane;1-ethyl-4-hydroxy-4-methylpiperidine-2,6-dione.
What is the SMILES notation for ethane;1-ethyl-4-hydroxy-4-methylpiperidine-2,6-dione?
The canonical SMILES for ethane;1-ethyl-4-hydroxy-4-methylpiperidine-2,6-dione is CC.CCN1C(=O)CC(C)(O)CC1=O.
What is the InChIKey of ethane;1-ethyl-4-hydroxy-4-methylpiperidine-2,6-dione?
The InChIKey is RYLDHYLALRHUGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO3.C2H6/c1-3-9-6(10)4-8(2,12)5-7(9)11;1-2/h12H,3-5H2,1-2H3;1-2H3.
What are the key properties of ethane;1-ethyl-4-hydroxy-4-methylpiperidine-2,6-dione?
ethane;1-ethyl-4-hydroxy-4-methylpiperidine-2,6-dione has a molecular weight of 201.27 g/mol, XLogP of 0.93, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-ethyl-4-hydroxy-4-methylpiperidine-2,6-dione is sourced from PubChem (CID 143012313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).