3-[2-(oxolan-2-yl)ethyl]piperidine-2,6-dione

C11H17NO3 — CID 65165680

IUPAC3-[2-(oxolan-2-yl)ethyl]piperidine-2,6-dione
SMILESO=C1CCC(CCC2CCCO2)C(=O)N1
InChIInChI=1S/C11H17NO3/c13-10-6-4-8(11(14)12-10)3-5-9-2-1-7-15-9/h8-9H,1-7H2,(H,12,13,14)
InChIKeyONJJMSHKYDDZFR-UHFFFAOYSA-N
MW211.26 g/mol
LogP1.00
Rot. Bonds3

About 3-[2-(oxolan-2-yl)ethyl]piperidine-2,6-dione

3-[2-(oxolan-2-yl)ethyl]piperidine-2,6-dione (PubChem CID 65165680) has the molecular formula C11H17NO3 and a molecular weight of 211.26 g/mol. Its IUPAC name is 3-[2-(oxolan-2-yl)ethyl]piperidine-2,6-dione.

Molecular Properties

Compound Name3-[2-(oxolan-2-yl)ethyl]piperidine-2,6-dione
PubChem CID65165680
Molecular FormulaC11H17NO3
Molecular Weight211.26 g/mol
Exact Mass211.12
IUPAC Name3-[2-(oxolan-2-yl)ethyl]piperidine-2,6-dione
SMILESO=C1CCC(CCC2CCCO2)C(=O)N1
InChIInChI=1S/C11H17NO3/c13-10-6-4-8(11(14)12-10)3-5-9-2-1-7-15-9/h8-9H,1-7H2,(H,12,13,14)
InChIKeyONJJMSHKYDDZFR-UHFFFAOYSA-N
XLogP1.00
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 51.00
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

3-[2-(2,6-dioxopiperidin-3-yl)ethyl]piperidine-2,6-dione
CID 54373582
2-[2-(oxolan-2-yl)ethyl]cyclohexan-1-one
CID 65162914
4-[2-(oxolan-2-yl)ethyl]piperazine-2,6-dione
CID 63789085
3-[2-(2,5-dioxopyrrolidin-3-yl)ethyl]pyrrolidine-2,5-dione
CID 154234423
5-[2-(oxolan-2-yl)ethylamino]piperidin-2-one
CID 65163425
(3R)-3-[[(2R)-oxan-2-yl]methylamino]pyrrolidine-2,5-dione
CID 98630960
2-methyl-3-[2-(oxolan-2-yl)ethyl]cyclopentan-1-one
CID 65165695
3-[3-(oxolan-2-yl)propyl]cyclopentan-1-one
CID 65165417
3-[2-(1-oxo-3,4-dihydro-2H-naphthalen-2-yl)ethyl]piperidine-2,6-dione
CID 91165365
N-[4-[[(3R)-2,5-dioxopyrrolidin-3-yl]methyl]phenyl]-2-[(2S)-oxolan-2-yl]acetamide
CID 95774368
3-[2-(2-methylpropoxy)ethyl]piperidine-2,6-dione
CID 106458139
tert-butyl 4-oxo-3-[2-(oxolan-2-yl)ethyl]piperidine-1-carboxylate
CID 114451455

Frequently Asked Questions

What is the IUPAC name of 3-[2-(oxolan-2-yl)ethyl]piperidine-2,6-dione?
The IUPAC name of 3-[2-(oxolan-2-yl)ethyl]piperidine-2,6-dione (CID 65165680) is 3-[2-(oxolan-2-yl)ethyl]piperidine-2,6-dione.
What is the SMILES notation for 3-[2-(oxolan-2-yl)ethyl]piperidine-2,6-dione?
The canonical SMILES for 3-[2-(oxolan-2-yl)ethyl]piperidine-2,6-dione is O=C1CCC(CCC2CCCO2)C(=O)N1.
What is the InChIKey of 3-[2-(oxolan-2-yl)ethyl]piperidine-2,6-dione?
The InChIKey is ONJJMSHKYDDZFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO3/c13-10-6-4-8(11(14)12-10)3-5-9-2-1-7-15-9/h8-9H,1-7H2,(H,12,13,14).
What are the key properties of 3-[2-(oxolan-2-yl)ethyl]piperidine-2,6-dione?
3-[2-(oxolan-2-yl)ethyl]piperidine-2,6-dione has a molecular weight of 211.26 g/mol, XLogP of 1.00, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(oxolan-2-yl)ethyl]piperidine-2,6-dione is sourced from PubChem (CID 65165680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).