(5Z)-5-[(4-fluorophenyl)methylidene]-1-methylimidazolidine-2,4-dione

C11H9FN2O2 — CID 19589561

IUPAC(5Z)-5-[(4-fluorophenyl)methylidene]-1-methylimidazolidine-2,4-dione
SMILESCN1C(=O)NC(=O)/C1=C/c1ccc(F)cc1
InChIInChI=1S/C11H9FN2O2/c1-14-9(10(15)13-11(14)16)6-7-2-4-8(12)5-3-7/h2-6H,1H3,(H,13,15,16)/b9-6-
InChIKeyAKRXNRBGNINGAF-TWGQIWQCSA-N
MW220.20 g/mol
LogP1.35
Rot. Bonds1

About (5Z)-5-[(4-fluorophenyl)methylidene]-1-methylimidazolidine-2,4-dione

(5Z)-5-[(4-fluorophenyl)methylidene]-1-methylimidazolidine-2,4-dione (PubChem CID 19589561) has the molecular formula C11H9FN2O2 and a molecular weight of 220.20 g/mol. Its IUPAC name is (5Z)-5-[(4-fluorophenyl)methylidene]-1-methylimidazolidine-2,4-dione.

Molecular Properties

Compound Name(5Z)-5-[(4-fluorophenyl)methylidene]-1-methylimidazolidine-2,4-dione
PubChem CID19589561
Molecular FormulaC11H9FN2O2
Molecular Weight220.20 g/mol
Exact Mass220.06
IUPAC Name(5Z)-5-[(4-fluorophenyl)methylidene]-1-methylimidazolidine-2,4-dione
SMILESCN1C(=O)NC(=O)/C1=C/c1ccc(F)cc1
InChIInChI=1S/C11H9FN2O2/c1-14-9(10(15)13-11(14)16)6-7-2-4-8(12)5-3-7/h2-6H,1H3,(H,13,15,16)/b9-6-
InChIKeyAKRXNRBGNINGAF-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

1-methyl-5-(pyridin-4-ylmethylidene)imidazolidine-2,4-dione
CID 2751742
(5E)-1-methyl-5-(thiophen-3-ylmethylidene)imidazolidine-2,4-dione
CID 91989718
5-[(4-hydroxy-3,5-dimethoxyphenyl)methylidene]-1-methylimidazolidine-2,4-dione
CID 54295043
(5Z)-5-[(4-hydroxyphenyl)methylidene]-1-methyl-1,3-diazinane-2,4,6-trione
CID 5396492
(5E)-5-[(4-hydroxyphenyl)methylidene]-1-methyl-1,3-diazinane-2,4,6-trione
CID 5291810
(5Z)-5-[(2,4-dichlorophenyl)methylidene]-1-methylimidazolidine-2,4-dione
CID 51062684
(5E)-5-benzylidene-1-methyl-2-methyliminoimidazolidin-4-one
CID 136665060
(5Z)-3-benzyl-5-[(4-fluorophenyl)methylidene]-1-methyl-2-sulfanylideneimidazolidin-4-one
CID 11278827
3-[(4-fluorophenyl)methylidene]-1-methylindol-2-one
CID 964242
(5Z)-1-methyl-5-[(4-phenoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione
CID 5350951
(5Z)-3-[(4-chlorophenyl)methyl]-5-[(4-fluorophenyl)methylidene]-1-methyl-2-sulfanylideneimidazolidin-4-one
CID 11152628
(5Z)-5-[(4-bromophenyl)methylidene]-1-(4-fluorobenzoyl)-2-sulfanylideneimidazolidin-4-one
CID 1098704

Frequently Asked Questions

What is the IUPAC name of (5Z)-5-[(4-fluorophenyl)methylidene]-1-methylimidazolidine-2,4-dione?
The IUPAC name of (5Z)-5-[(4-fluorophenyl)methylidene]-1-methylimidazolidine-2,4-dione (CID 19589561) is (5Z)-5-[(4-fluorophenyl)methylidene]-1-methylimidazolidine-2,4-dione.
What is the SMILES notation for (5Z)-5-[(4-fluorophenyl)methylidene]-1-methylimidazolidine-2,4-dione?
The canonical SMILES for (5Z)-5-[(4-fluorophenyl)methylidene]-1-methylimidazolidine-2,4-dione is CN1C(=O)NC(=O)/C1=C/c1ccc(F)cc1.
What is the InChIKey of (5Z)-5-[(4-fluorophenyl)methylidene]-1-methylimidazolidine-2,4-dione?
The InChIKey is AKRXNRBGNINGAF-TWGQIWQCSA-N. The full InChI is InChI=1S/C11H9FN2O2/c1-14-9(10(15)13-11(14)16)6-7-2-4-8(12)5-3-7/h2-6H,1H3,(H,13,15,16)/b9-6-.
What are the key properties of (5Z)-5-[(4-fluorophenyl)methylidene]-1-methylimidazolidine-2,4-dione?
(5Z)-5-[(4-fluorophenyl)methylidene]-1-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-[(4-fluorophenyl)methylidene]-1-methylimidazolidine-2,4-dione is sourced from PubChem (CID 19589561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).