4,5-bis[(Z)-pent-3-enoxy]imidazolidin-2-one

C13H22N2O3 — CID 24839045

IUPAC4,5-bis[(Z)-pent-3-enoxy]imidazolidin-2-one
SMILESC/C=C\CCOC1NC(=O)NC1OCC/C=C\C
InChIInChI=1S/C13H22N2O3/c1-3-5-7-9-17-11-12(15-13(16)14-11)18-10-8-6-4-2/h3-6,11-12H,7-10H2,1-2H3,(H2,14,15,16)/b5-3-,6-4-
InChIKeyUVZVKZNWHLABCG-GLIMQPGKSA-N
MW254.33 g/mol
LogP1.92
Rot. Bonds8

About 4,5-bis[(Z)-pent-3-enoxy]imidazolidin-2-one

4,5-bis[(Z)-pent-3-enoxy]imidazolidin-2-one (PubChem CID 24839045) has the molecular formula C13H22N2O3 and a molecular weight of 254.33 g/mol. Its IUPAC name is 4,5-bis[(Z)-pent-3-enoxy]imidazolidin-2-one.

Molecular Properties

Compound Name4,5-bis[(Z)-pent-3-enoxy]imidazolidin-2-one
PubChem CID24839045
Molecular FormulaC13H22N2O3
Molecular Weight254.33 g/mol
Exact Mass254.16
IUPAC Name4,5-bis[(Z)-pent-3-enoxy]imidazolidin-2-one
SMILESC/C=C\CCOC1NC(=O)NC1OCC/C=C\C
InChIInChI=1S/C13H22N2O3/c1-3-5-7-9-17-11-12(15-13(16)14-11)18-10-8-6-4-2/h3-6,11-12H,7-10H2,1-2H3,(H2,14,15,16)/b5-3-,6-4-
InChIKeyUVZVKZNWHLABCG-GLIMQPGKSA-N
XLogP1.92
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4,5-bis[(Z)-pent-3-enoxy]imidazolidin-2-one?
The IUPAC name of 4,5-bis[(Z)-pent-3-enoxy]imidazolidin-2-one (CID 24839045) is 4,5-bis[(Z)-pent-3-enoxy]imidazolidin-2-one.
What is the SMILES notation for 4,5-bis[(Z)-pent-3-enoxy]imidazolidin-2-one?
The canonical SMILES for 4,5-bis[(Z)-pent-3-enoxy]imidazolidin-2-one is C/C=C\CCOC1NC(=O)NC1OCC/C=C\C.
What is the InChIKey of 4,5-bis[(Z)-pent-3-enoxy]imidazolidin-2-one?
The InChIKey is UVZVKZNWHLABCG-GLIMQPGKSA-N. The full InChI is InChI=1S/C13H22N2O3/c1-3-5-7-9-17-11-12(15-13(16)14-11)18-10-8-6-4-2/h3-6,11-12H,7-10H2,1-2H3,(H2,14,15,16)/b5-3-,6-4-.
What are the key properties of 4,5-bis[(Z)-pent-3-enoxy]imidazolidin-2-one?
4,5-bis[(Z)-pent-3-enoxy]imidazolidin-2-one has a molecular weight of 254.33 g/mol, XLogP of 1.92, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-bis[(Z)-pent-3-enoxy]imidazolidin-2-one is sourced from PubChem (CID 24839045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).