5-[4-ethenyl-5-[(E)-1-fluoroprop-1-enyl]furan-2-yl]imidazolidine-2,4-dione

C12H11FN2O3 — CID 143510384

IUPAC5-[4-ethenyl-5-[(E)-1-fluoroprop-1-enyl]furan-2-yl]imidazolidine-2,4-dione
SMILESC=Cc1cc(C2NC(=O)NC2=O)oc1/C(F)=C\C
InChIInChI=1S/C12H11FN2O3/c1-3-6-5-8(18-10(6)7(13)4-2)9-11(16)15-12(17)14-9/h3-5,9H,1H2,2H3,(H2,14,15,16,17)/b7-4+
InChIKeyCKKSRIAOWBPKMK-QPJJXVBHSA-N
MW250.23 g/mol
LogP2.13
Rot. Bonds3

About 5-[4-ethenyl-5-[(E)-1-fluoroprop-1-enyl]furan-2-yl]imidazolidine-2,4-dione

5-[4-ethenyl-5-[(E)-1-fluoroprop-1-enyl]furan-2-yl]imidazolidine-2,4-dione (PubChem CID 143510384) has the molecular formula C12H11FN2O3 and a molecular weight of 250.23 g/mol. Its IUPAC name is 5-[4-ethenyl-5-[(E)-1-fluoroprop-1-enyl]furan-2-yl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name5-[4-ethenyl-5-[(E)-1-fluoroprop-1-enyl]furan-2-yl]imidazolidine-2,4-dione
PubChem CID143510384
Molecular FormulaC12H11FN2O3
Molecular Weight250.23 g/mol
Exact Mass250.08
IUPAC Name5-[4-ethenyl-5-[(E)-1-fluoroprop-1-enyl]furan-2-yl]imidazolidine-2,4-dione
SMILESC=Cc1cc(C2NC(=O)NC2=O)oc1/C(F)=C\C
InChIInChI=1S/C12H11FN2O3/c1-3-6-5-8(18-10(6)7(13)4-2)9-11(16)15-12(17)14-9/h3-5,9H,1H2,2H3,(H2,14,15,16,17)/b7-4+
InChIKeyCKKSRIAOWBPKMK-QPJJXVBHSA-N
XLogP2.13
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.23
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 5-[4-ethenyl-5-[(E)-1-fluoroprop-1-enyl]furan-2-yl]imidazolidine-2,4-dione with MolForge

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Related Compounds

5-(2-Furyl)-5-methylimidazolidine-2,4-dione
CID 289051
5-(Furan-2-yl)imidazolidine-2,4-dione
CID 226067
2-fluoro-N-[2-(furan-2-yl)-2-(pyrrolidin-1-yl)ethyl]benzamide
CID 4883721
N-[2-[[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]amino]-2-oxoethyl]benzamide
CID 4879435
(2S,5S)-(-)-5-Benzyl-3-methyl-2-(5-methyl-2-furyl)-4-imidazolidinone
CID 11303220
2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)-N-methyl-N-[(5-methylfuran-2-yl)methyl]acetamide
CID 25162209
2-(5-{1-[(aminocarbonyl)(hydroxy)amino]ethyl}-2-furyl)-N-benzylacetamide
CID 10495686
alpha-Acetamido-N-benzyl-alpha-(furan-2-yl)acetamide
CID 130180
alpha-acetamido-N-(4-fluorobenzyl)-alpha-(furan-2-yl)acetamide
CID 130181
2-acetamido-N-benzyl-2-(5-methylfuran-2-yl)acetamide
CID 14212835
2-acetamido-N-[(2-fluorophenyl)methyl]-2-(furan-2-yl)acetamide
CID 14522753
2-acetamido-N-[(3-fluorophenyl)methyl]-2-(furan-2-yl)acetamide
CID 14522754

Frequently Asked Questions

What is the IUPAC name of 5-[4-ethenyl-5-[(E)-1-fluoroprop-1-enyl]furan-2-yl]imidazolidine-2,4-dione?
The IUPAC name of 5-[4-ethenyl-5-[(E)-1-fluoroprop-1-enyl]furan-2-yl]imidazolidine-2,4-dione (CID 143510384) is 5-[4-ethenyl-5-[(E)-1-fluoroprop-1-enyl]furan-2-yl]imidazolidine-2,4-dione.
What is the SMILES notation for 5-[4-ethenyl-5-[(E)-1-fluoroprop-1-enyl]furan-2-yl]imidazolidine-2,4-dione?
The canonical SMILES for 5-[4-ethenyl-5-[(E)-1-fluoroprop-1-enyl]furan-2-yl]imidazolidine-2,4-dione is C=Cc1cc(C2NC(=O)NC2=O)oc1/C(F)=C\C.
What is the InChIKey of 5-[4-ethenyl-5-[(E)-1-fluoroprop-1-enyl]furan-2-yl]imidazolidine-2,4-dione?
The InChIKey is CKKSRIAOWBPKMK-QPJJXVBHSA-N. The full InChI is InChI=1S/C12H11FN2O3/c1-3-6-5-8(18-10(6)7(13)4-2)9-11(16)15-12(17)14-9/h3-5,9H,1H2,2H3,(H2,14,15,16,17)/b7-4+.
What are the key properties of 5-[4-ethenyl-5-[(E)-1-fluoroprop-1-enyl]furan-2-yl]imidazolidine-2,4-dione?
5-[4-ethenyl-5-[(E)-1-fluoroprop-1-enyl]furan-2-yl]imidazolidine-2,4-dione has a molecular weight of 250.23 g/mol, XLogP of 2.13, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-ethenyl-5-[(E)-1-fluoroprop-1-enyl]furan-2-yl]imidazolidine-2,4-dione is sourced from PubChem (CID 143510384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).