4-[1-(oxolan-2-yl)ethyl]morpholine-2,6-dione

C10H15NO4 — CID 63779053

IUPAC4-[1-(oxolan-2-yl)ethyl]morpholine-2,6-dione
SMILESCC(C1CCCO1)N1CC(=O)OC(=O)C1
InChIInChI=1S/C10H15NO4/c1-7(8-3-2-4-14-8)11-5-9(12)15-10(13)6-11/h7-8H,2-6H2,1H3
InChIKeyVKWBUYKMOFOPKC-UHFFFAOYSA-N
MW213.23 g/mol
LogP-0.06
Rot. Bonds2

About 4-[1-(oxolan-2-yl)ethyl]morpholine-2,6-dione

4-[1-(oxolan-2-yl)ethyl]morpholine-2,6-dione (PubChem CID 63779053) has the molecular formula C10H15NO4 and a molecular weight of 213.23 g/mol. Its IUPAC name is 4-[1-(oxolan-2-yl)ethyl]morpholine-2,6-dione.

Molecular Properties

Compound Name4-[1-(oxolan-2-yl)ethyl]morpholine-2,6-dione
PubChem CID63779053
Molecular FormulaC10H15NO4
Molecular Weight213.23 g/mol
Exact Mass213.10
IUPAC Name4-[1-(oxolan-2-yl)ethyl]morpholine-2,6-dione
SMILESCC(C1CCCO1)N1CC(=O)OC(=O)C1
InChIInChI=1S/C10H15NO4/c1-7(8-3-2-4-14-8)11-5-9(12)15-10(13)6-11/h7-8H,2-6H2,1H3
InChIKeyVKWBUYKMOFOPKC-UHFFFAOYSA-N
XLogP-0.06
TPSA55.84 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.23
LogP ≤ 5-0.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

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Related Compounds

2-(3-Oxa-8-azabicyclo[3.2.1]octan-8-yl)acetic acid
CID 176955971
Methyl 2-[oxolan-2-ylmethyl(propan-2-yl)amino]acetate
CID 55149055
Ethyl 2-[oxolan-2-ylmethyl(propan-2-yl)amino]acetate
CID 61517315
Ethyl 2-[oxan-2-ylmethyl(propan-2-yl)amino]acetate
CID 61517711
Methyl 2-[oxan-2-ylmethyl(propan-2-yl)amino]acetate
CID 61518060
Ethyl 2-[methyl(oxolan-2-ylmethyl)amino]propanoate
CID 61721114
Ethyl 2-[methyl(oxan-2-ylmethyl)amino]propanoate
CID 61721115
Ethyl 2-[ethyl(oxolan-2-ylmethyl)amino]propanoate
CID 61721318
Methyl 2-[methyl(oxolan-2-ylmethyl)amino]propanoate
CID 61723863
Methyl 2-[methyl(oxan-2-ylmethyl)amino]propanoate
CID 61723864
Methyl 2-[ethyl(oxolan-2-ylmethyl)amino]propanoate
CID 61723866
Methyl 1-(oxan-2-ylmethyl)pyrrolidine-2-carboxylate
CID 62028239

Frequently Asked Questions

What is the IUPAC name of 4-[1-(oxolan-2-yl)ethyl]morpholine-2,6-dione?
The IUPAC name of 4-[1-(oxolan-2-yl)ethyl]morpholine-2,6-dione (CID 63779053) is 4-[1-(oxolan-2-yl)ethyl]morpholine-2,6-dione.
What is the SMILES notation for 4-[1-(oxolan-2-yl)ethyl]morpholine-2,6-dione?
The canonical SMILES for 4-[1-(oxolan-2-yl)ethyl]morpholine-2,6-dione is CC(C1CCCO1)N1CC(=O)OC(=O)C1.
What is the InChIKey of 4-[1-(oxolan-2-yl)ethyl]morpholine-2,6-dione?
The InChIKey is VKWBUYKMOFOPKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO4/c1-7(8-3-2-4-14-8)11-5-9(12)15-10(13)6-11/h7-8H,2-6H2,1H3.
What are the key properties of 4-[1-(oxolan-2-yl)ethyl]morpholine-2,6-dione?
4-[1-(oxolan-2-yl)ethyl]morpholine-2,6-dione has a molecular weight of 213.23 g/mol, XLogP of -0.06, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(oxolan-2-yl)ethyl]morpholine-2,6-dione is sourced from PubChem (CID 63779053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).