(5Z)-5-[(2-fluorophenyl)methylidene]-3-methylimidazolidine-2,4-dione

C11H9FN2O2 — CID 125493925

IUPAC(5Z)-5-[(2-fluorophenyl)methylidene]-3-methylimidazolidine-2,4-dione
SMILESCN1C(=O)N/C(=C\c2ccccc2F)C1=O
InChIInChI=1S/C11H9FN2O2/c1-14-10(15)9(13-11(14)16)6-7-4-2-3-5-8(7)12/h2-6H,1H3,(H,13,16)/b9-6-
InChIKeyZYPAMKGPALLWSR-TWGQIWQCSA-N
MW220.20 g/mol
LogP1.35
Rot. Bonds1

About (5Z)-5-[(2-fluorophenyl)methylidene]-3-methylimidazolidine-2,4-dione

(5Z)-5-[(2-fluorophenyl)methylidene]-3-methylimidazolidine-2,4-dione (PubChem CID 125493925) has the molecular formula C11H9FN2O2 and a molecular weight of 220.20 g/mol. Its IUPAC name is (5Z)-5-[(2-fluorophenyl)methylidene]-3-methylimidazolidine-2,4-dione.

Molecular Properties

Compound Name(5Z)-5-[(2-fluorophenyl)methylidene]-3-methylimidazolidine-2,4-dione
PubChem CID125493925
Molecular FormulaC11H9FN2O2
Molecular Weight220.20 g/mol
Exact Mass220.06
IUPAC Name(5Z)-5-[(2-fluorophenyl)methylidene]-3-methylimidazolidine-2,4-dione
SMILESCN1C(=O)N/C(=C\c2ccccc2F)C1=O
InChIInChI=1S/C11H9FN2O2/c1-14-10(15)9(13-11(14)16)6-7-4-2-3-5-8(7)12/h2-6H,1H3,(H,13,16)/b9-6-
InChIKeyZYPAMKGPALLWSR-TWGQIWQCSA-N
XLogP1.35
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.20
LogP ≤ 51.35
H-Bond Donors ≤ 51
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

(5E)-5-[(2-bromophenyl)methylidene]-3-methylimidazolidine-2,4-dione
CID 126200968
(5E)-5-[(2-fluoro-4-piperidin-1-ylphenyl)methylidene]-3-methylimidazolidine-2,4-dione
CID 126200336
3-methyl-5-[(2-phenylmethoxyphenyl)methylidene]imidazolidine-2,4-dione
CID 4013801
5-(isoquinolin-4-ylmethylidene)-3-methylimidazolidine-2,4-dione
CID 156538083
(5Z)-5-[(2-hydroxyphenyl)methylidene]-3-methyl-2-sulfanylideneimidazolidin-4-one
CID 5415539
N-(4-fluorophenyl)-2-[(4Z)-4-[(2-fluorophenyl)methylidene]-2,5-dioxoimidazolidin-1-yl]acetamide
CID 16632699
(5E)-3-methyl-5-[(5-phenylfuran-2-yl)methylidene]imidazolidine-2,4-dione
CID 126199485
2-[2-[(E)-(1-methyl-2,5-dioxoimidazolidin-4-ylidene)methyl]phenoxy]-N-phenylacetamide
CID 6520725
(5E)-5-[[3-ethoxy-4-[(2-fluorophenyl)methoxy]phenyl]methylidene]-3-methylimidazolidine-2,4-dione
CID 126199554
(5E)-5-[(2-chlorophenyl)methylidene]-3-[(2-fluorophenyl)methyl]imidazolidine-2,4-dione
CID 126110932
(5E)-3-methyl-5-[(2-phenylimidazo[1,2-a]pyridin-3-yl)methylidene]imidazolidine-2,4-dione
CID 177495034
2-[2-[(E)-(1-methyl-2,5-dioxoimidazolidin-4-ylidene)methyl]phenoxy]-N-(4-methylphenyl)acetamide
CID 126194833

Frequently Asked Questions

What is the IUPAC name of (5Z)-5-[(2-fluorophenyl)methylidene]-3-methylimidazolidine-2,4-dione?
The IUPAC name of (5Z)-5-[(2-fluorophenyl)methylidene]-3-methylimidazolidine-2,4-dione (CID 125493925) is (5Z)-5-[(2-fluorophenyl)methylidene]-3-methylimidazolidine-2,4-dione.
What is the SMILES notation for (5Z)-5-[(2-fluorophenyl)methylidene]-3-methylimidazolidine-2,4-dione?
The canonical SMILES for (5Z)-5-[(2-fluorophenyl)methylidene]-3-methylimidazolidine-2,4-dione is CN1C(=O)N/C(=C\c2ccccc2F)C1=O.
What is the InChIKey of (5Z)-5-[(2-fluorophenyl)methylidene]-3-methylimidazolidine-2,4-dione?
The InChIKey is ZYPAMKGPALLWSR-TWGQIWQCSA-N. The full InChI is InChI=1S/C11H9FN2O2/c1-14-10(15)9(13-11(14)16)6-7-4-2-3-5-8(7)12/h2-6H,1H3,(H,13,16)/b9-6-.
What are the key properties of (5Z)-5-[(2-fluorophenyl)methylidene]-3-methylimidazolidine-2,4-dione?
(5Z)-5-[(2-fluorophenyl)methylidene]-3-methylimidazolidine-2,4-dione has a molecular weight of 220.20 g/mol, XLogP of 1.35, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z)-5-[(2-fluorophenyl)methylidene]-3-methylimidazolidine-2,4-dione is sourced from PubChem (CID 125493925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).