5-ethylideneimidazolidine-2,4-dione

C5H6N2O2 — CID 59815931

IUPAC5-ethylideneimidazolidine-2,4-dione
SMILESCC=C1NC(=O)NC1=O
InChIInChI=1S/C5H6N2O2/c1-2-3-4(8)7-5(9)6-3/h2H,1H3,(H2,6,7,8,9)
InChIKeyUGIOACMSGGVRIA-UHFFFAOYSA-N
MW126.11 g/mol
LogP-0.27
Rot. Bonds

About 5-ethylideneimidazolidine-2,4-dione

5-ethylideneimidazolidine-2,4-dione (PubChem CID 59815931) has the molecular formula C5H6N2O2 and a molecular weight of 126.11 g/mol. Its IUPAC name is 5-ethylideneimidazolidine-2,4-dione.

Molecular Properties

Compound Name5-ethylideneimidazolidine-2,4-dione
PubChem CID59815931
Molecular FormulaC5H6N2O2
Molecular Weight126.11 g/mol
Exact Mass126.04
IUPAC Name5-ethylideneimidazolidine-2,4-dione
SMILESCC=C1NC(=O)NC1=O
InChIInChI=1S/C5H6N2O2/c1-2-3-4(8)7-5(9)6-3/h2H,1H3,(H2,6,7,8,9)
InChIKeyUGIOACMSGGVRIA-UHFFFAOYSA-N
XLogP-0.27
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.11
LogP ≤ 5-0.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

5-(Propan-2-Ylidene)Imidazolidine-2,4-Dione
CID 336450
(5Z)-5-ethylidene-2-sulfanylideneimidazolidin-4-one
CID 13280114
(5Z)-5-(2-methylpropylidene)imidazolidine-2,4-dione
CID 13392838
2,6-Dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxamide
CID 248966
5-Methyleneimidazolidine-2,4-dione
CID 574313
5-(Methoxymethylene)-2,4-imidazolidinedione
CID 3035670
5-(2-Methylpropylidene)-2,4-imidazolidinedione
CID 57053407
5-Ethylidene-2-thioxo-4-imidazolidinone
CID 73179893
5-Methoxymethylene-hydantoin
CID 126218
1-Acetyl-5-methylideneimidazolidine-2,4-dione
CID 11788405
(2Z)-2-(1-methyl-2,5-dioxoimidazolidin-4-ylidene)acetonitrile
CID 12024419
(5Z)-5-(2,3,3,3-tetradeuterio-2-(113C)methylpropylidene)imidazolidine-2,4-dione
CID 135044041

Frequently Asked Questions

What is the IUPAC name of 5-ethylideneimidazolidine-2,4-dione?
The IUPAC name of 5-ethylideneimidazolidine-2,4-dione (CID 59815931) is 5-ethylideneimidazolidine-2,4-dione.
What is the SMILES notation for 5-ethylideneimidazolidine-2,4-dione?
The canonical SMILES for 5-ethylideneimidazolidine-2,4-dione is CC=C1NC(=O)NC1=O.
What is the InChIKey of 5-ethylideneimidazolidine-2,4-dione?
The InChIKey is UGIOACMSGGVRIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6N2O2/c1-2-3-4(8)7-5(9)6-3/h2H,1H3,(H2,6,7,8,9).
What are the key properties of 5-ethylideneimidazolidine-2,4-dione?
5-ethylideneimidazolidine-2,4-dione has a molecular weight of 126.11 g/mol, XLogP of -0.27, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethylideneimidazolidine-2,4-dione is sourced from PubChem (CID 59815931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).