5-ethenylidene-1-ethyl-3-propan-2-ylimidazolidine-2,4-dione

C10H14N2O2 — CID 162700876

IUPAC5-ethenylidene-1-ethyl-3-propan-2-ylimidazolidine-2,4-dione
SMILESC=C=C1C(=O)N(C(C)C)C(=O)N1CC
InChIInChI=1S/C10H14N2O2/c1-5-8-9(13)12(7(3)4)10(14)11(8)6-2/h7H,1,6H2,2-4H3
InChIKeyRRPBIJBKEXYMNE-UHFFFAOYSA-N
MW194.23 g/mol
LogP1.35
Rot. Bonds2

About 5-ethenylidene-1-ethyl-3-propan-2-ylimidazolidine-2,4-dione

5-ethenylidene-1-ethyl-3-propan-2-ylimidazolidine-2,4-dione (PubChem CID 162700876) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is 5-ethenylidene-1-ethyl-3-propan-2-ylimidazolidine-2,4-dione.

Molecular Properties

Compound Name5-ethenylidene-1-ethyl-3-propan-2-ylimidazolidine-2,4-dione
PubChem CID162700876
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Name5-ethenylidene-1-ethyl-3-propan-2-ylimidazolidine-2,4-dione
SMILESC=C=C1C(=O)N(C(C)C)C(=O)N1CC
InChIInChI=1S/C10H14N2O2/c1-5-8-9(13)12(7(3)4)10(14)11(8)6-2/h7H,1,6H2,2-4H3
InChIKeyRRPBIJBKEXYMNE-UHFFFAOYSA-N
XLogP1.35
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 51.35
H-Bond Donors ≤ 50
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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Frequently Asked Questions

What is the IUPAC name of 5-ethenylidene-1-ethyl-3-propan-2-ylimidazolidine-2,4-dione?
The IUPAC name of 5-ethenylidene-1-ethyl-3-propan-2-ylimidazolidine-2,4-dione (CID 162700876) is 5-ethenylidene-1-ethyl-3-propan-2-ylimidazolidine-2,4-dione.
What is the SMILES notation for 5-ethenylidene-1-ethyl-3-propan-2-ylimidazolidine-2,4-dione?
The canonical SMILES for 5-ethenylidene-1-ethyl-3-propan-2-ylimidazolidine-2,4-dione is C=C=C1C(=O)N(C(C)C)C(=O)N1CC.
What is the InChIKey of 5-ethenylidene-1-ethyl-3-propan-2-ylimidazolidine-2,4-dione?
The InChIKey is RRPBIJBKEXYMNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-5-8-9(13)12(7(3)4)10(14)11(8)6-2/h7H,1,6H2,2-4H3.
What are the key properties of 5-ethenylidene-1-ethyl-3-propan-2-ylimidazolidine-2,4-dione?
5-ethenylidene-1-ethyl-3-propan-2-ylimidazolidine-2,4-dione has a molecular weight of 194.23 g/mol, XLogP of 1.35, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethenylidene-1-ethyl-3-propan-2-ylimidazolidine-2,4-dione is sourced from PubChem (CID 162700876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).