3-methylidene-1-(3-methylidene-2,5-dioxopyrrolidin-1-yl)oxypyrrolidine-2,5-dione

C10H8N2O5 — CID 143820346

IUPAC3-methylidene-1-(3-methylidene-2,5-dioxopyrrolidin-1-yl)oxypyrrolidine-2,5-dione
SMILESC=C1CC(=O)N(ON2C(=O)CC(=C)C2=O)C1=O
InChIInChI=1S/C10H8N2O5/c1-5-3-7(13)11(9(5)15)17-12-8(14)4-6(2)10(12)16/h1-4H2
InChIKeySVDNOUCDJBENFR-UHFFFAOYSA-N
MW236.18 g/mol
LogP-0.54
Rot. Bonds2

About 3-methylidene-1-(3-methylidene-2,5-dioxopyrrolidin-1-yl)oxypyrrolidine-2,5-dione

3-methylidene-1-(3-methylidene-2,5-dioxopyrrolidin-1-yl)oxypyrrolidine-2,5-dione (PubChem CID 143820346) has the molecular formula C10H8N2O5 and a molecular weight of 236.18 g/mol. Its IUPAC name is 3-methylidene-1-(3-methylidene-2,5-dioxopyrrolidin-1-yl)oxypyrrolidine-2,5-dione.

Molecular Properties

Compound Name3-methylidene-1-(3-methylidene-2,5-dioxopyrrolidin-1-yl)oxypyrrolidine-2,5-dione
PubChem CID143820346
Molecular FormulaC10H8N2O5
Molecular Weight236.18 g/mol
Exact Mass236.04
IUPAC Name3-methylidene-1-(3-methylidene-2,5-dioxopyrrolidin-1-yl)oxypyrrolidine-2,5-dione
SMILESC=C1CC(=O)N(ON2C(=O)CC(=C)C2=O)C1=O
InChIInChI=1S/C10H8N2O5/c1-5-3-7(13)11(9(5)15)17-12-8(14)4-6(2)10(12)16/h1-4H2
InChIKeySVDNOUCDJBENFR-UHFFFAOYSA-N
XLogP-0.54
TPSA83.99 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.18
LogP ≤ 5-0.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Related Compounds

3-methylidene-1-[(3-methylidene-2,5-dioxopyrrolidin-1-yl)methyl]pyrrolidine-2,5-dione
CID 165109067
1-ethynyl-3-methylidenepyrrolidine-2,5-dione
CID 164846198
3-methylidene-1-phenylpyrrolidine-2,5-dione
CID 13108227
1-(2-aminoethyl)-3-methylidenepyrrolidine-2,5-dione;ethane
CID 142439649
methane;1-methyl-3-methylidenepyrrolidine-2,5-dione;1-methylpyrrole-2,5-dione
CID 162091684
2-methylidenecyclopropan-1-one
CID 19064098
3-methylidene-1-pyridin-4-ylpyrrolidine-2,5-dione
CID 155351156
1-(2,6-diethylphenyl)-3-methylidenepyrrolidine-2,5-dione
CID 14449115
2-(3-methylidene-2,5-dioxopyrrolidin-1-yl)-N-[1-[1-[1-[1-[2-(3-methylidene-2,5-dioxopyrrolidin-1-yl)propanoylamino]ethylamino]ethylamino]ethylamino]ethyl]propanamide
CID 88555792
3-methyl-1-[[3-[(3-methylidene-2,5-dioxopyrrolidin-1-yl)methyl]phenyl]methyl]pyrrole-2,5-dione
CID 101148281
N-[2-[2-aminoethyl-[2-[3-(3-methylidene-2,5-dioxopyrrolidin-1-yl)propanoylamino]ethyl]amino]ethyl]-3-(3-methylidene-2,5-dioxopyrrolidin-1-yl)propanamide
CID 59281651
1-(3-methylbutan-2-yl)-3-methylidenepyrrolidin-2-one
CID 155354880

Frequently Asked Questions

What is the IUPAC name of 3-methylidene-1-(3-methylidene-2,5-dioxopyrrolidin-1-yl)oxypyrrolidine-2,5-dione?
The IUPAC name of 3-methylidene-1-(3-methylidene-2,5-dioxopyrrolidin-1-yl)oxypyrrolidine-2,5-dione (CID 143820346) is 3-methylidene-1-(3-methylidene-2,5-dioxopyrrolidin-1-yl)oxypyrrolidine-2,5-dione.
What is the SMILES notation for 3-methylidene-1-(3-methylidene-2,5-dioxopyrrolidin-1-yl)oxypyrrolidine-2,5-dione?
The canonical SMILES for 3-methylidene-1-(3-methylidene-2,5-dioxopyrrolidin-1-yl)oxypyrrolidine-2,5-dione is C=C1CC(=O)N(ON2C(=O)CC(=C)C2=O)C1=O.
What is the InChIKey of 3-methylidene-1-(3-methylidene-2,5-dioxopyrrolidin-1-yl)oxypyrrolidine-2,5-dione?
The InChIKey is SVDNOUCDJBENFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N2O5/c1-5-3-7(13)11(9(5)15)17-12-8(14)4-6(2)10(12)16/h1-4H2.
What are the key properties of 3-methylidene-1-(3-methylidene-2,5-dioxopyrrolidin-1-yl)oxypyrrolidine-2,5-dione?
3-methylidene-1-(3-methylidene-2,5-dioxopyrrolidin-1-yl)oxypyrrolidine-2,5-dione has a molecular weight of 236.18 g/mol, XLogP of -0.54, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylidene-1-(3-methylidene-2,5-dioxopyrrolidin-1-yl)oxypyrrolidine-2,5-dione is sourced from PubChem (CID 143820346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).