3-cyclobutyl-1-prop-2-enylimidazolidine-2,4-dione

C10H14N2O2 — CID 116658453

IUPAC3-cyclobutyl-1-prop-2-enylimidazolidine-2,4-dione
SMILESC=CCN1CC(=O)N(C2CCC2)C1=O
InChIInChI=1S/C10H14N2O2/c1-2-6-11-7-9(13)12(10(11)14)8-4-3-5-8/h2,8H,1,3-7H2
InChIKeyASRFDKPVPUJXEH-UHFFFAOYSA-N
MW194.23 g/mol
LogP0.99
Rot. Bonds3

About 3-cyclobutyl-1-prop-2-enylimidazolidine-2,4-dione

3-cyclobutyl-1-prop-2-enylimidazolidine-2,4-dione (PubChem CID 116658453) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is 3-cyclobutyl-1-prop-2-enylimidazolidine-2,4-dione.

Molecular Properties

Compound Name3-cyclobutyl-1-prop-2-enylimidazolidine-2,4-dione
PubChem CID116658453
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Name3-cyclobutyl-1-prop-2-enylimidazolidine-2,4-dione
SMILESC=CCN1CC(=O)N(C2CCC2)C1=O
InChIInChI=1S/C10H14N2O2/c1-2-6-11-7-9(13)12(10(11)14)8-4-3-5-8/h2,8H,1,3-7H2
InChIKeyASRFDKPVPUJXEH-UHFFFAOYSA-N
XLogP0.99
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 50.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-cyclobutyl-1-prop-2-enylimidazolidine-2,4-dione?
The IUPAC name of 3-cyclobutyl-1-prop-2-enylimidazolidine-2,4-dione (CID 116658453) is 3-cyclobutyl-1-prop-2-enylimidazolidine-2,4-dione.
What is the SMILES notation for 3-cyclobutyl-1-prop-2-enylimidazolidine-2,4-dione?
The canonical SMILES for 3-cyclobutyl-1-prop-2-enylimidazolidine-2,4-dione is C=CCN1CC(=O)N(C2CCC2)C1=O.
What is the InChIKey of 3-cyclobutyl-1-prop-2-enylimidazolidine-2,4-dione?
The InChIKey is ASRFDKPVPUJXEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-2-6-11-7-9(13)12(10(11)14)8-4-3-5-8/h2,8H,1,3-7H2.
What are the key properties of 3-cyclobutyl-1-prop-2-enylimidazolidine-2,4-dione?
3-cyclobutyl-1-prop-2-enylimidazolidine-2,4-dione has a molecular weight of 194.23 g/mol, XLogP of 0.99, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclobutyl-1-prop-2-enylimidazolidine-2,4-dione is sourced from PubChem (CID 116658453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).