(5Z)-5-[(4-methylphenyl)methylidene]imidazolidine-2,4-dione

C11H10N2O2 — CID 697033

IUPAC(5Z)-5-[(4-methylphenyl)methylidene]imidazolidine-2,4-dione
SMILESCc1ccc(/C=C2\NC(=O)NC2=O)cc1
InChIInChI=1S/C11H10N2O2/c1-7-2-4-8(5-3-7)6-9-10(14)13-11(15)12-9/h2-6H,1H3,(H2,12,13,14,15)/b9-6-
InChIKeyMDJFPRDVZHNPSA-TWGQIWQCSA-N
MW202.21 g/mol
LogP1.18
Rot. Bonds1

About (5Z)-5-[(4-methylphenyl)methylidene]imidazolidine-2,4-dione

(5Z)-5-[(4-methylphenyl)methylidene]imidazolidine-2,4-dione (PubChem CID 697033) has the molecular formula C11H10N2O2 and a molecular weight of 202.21 g/mol. Its IUPAC name is (5Z)-5-[(4-methylphenyl)methylidene]imidazolidine-2,4-dione.

Molecular Properties

Compound Name(5Z)-5-[(4-methylphenyl)methylidene]imidazolidine-2,4-dione
PubChem CID697033
Molecular FormulaC11H10N2O2
Molecular Weight202.21 g/mol
Exact Mass202.07
IUPAC Name(5Z)-5-[(4-methylphenyl)methylidene]imidazolidine-2,4-dione
SMILESCc1ccc(/C=C2\NC(=O)NC2=O)cc1
InChIInChI=1S/C11H10N2O2/c1-7-2-4-8(5-3-7)6-9-10(14)13-11(15)12-9/h2-6H,1H3,(H2,12,13,14,15)/b9-6-
InChIKeyMDJFPRDVZHNPSA-TWGQIWQCSA-N
XLogP1.18
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.21
LogP ≤ 51.18
H-Bond Donors ≤ 52
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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Frequently Asked Questions

What is the IUPAC name of (5Z)-5-[(4-methylphenyl)methylidene]imidazolidine-2,4-dione?
The IUPAC name of (5Z)-5-[(4-methylphenyl)methylidene]imidazolidine-2,4-dione (CID 697033) is (5Z)-5-[(4-methylphenyl)methylidene]imidazolidine-2,4-dione.
What is the SMILES notation for (5Z)-5-[(4-methylphenyl)methylidene]imidazolidine-2,4-dione?
The canonical SMILES for (5Z)-5-[(4-methylphenyl)methylidene]imidazolidine-2,4-dione is Cc1ccc(/C=C2\NC(=O)NC2=O)cc1.
What is the InChIKey of (5Z)-5-[(4-methylphenyl)methylidene]imidazolidine-2,4-dione?
The InChIKey is MDJFPRDVZHNPSA-TWGQIWQCSA-N. The full InChI is InChI=1S/C11H10N2O2/c1-7-2-4-8(5-3-7)6-9-10(14)13-11(15)12-9/h2-6H,1H3,(H2,12,13,14,15)/b9-6-.
What are the key properties of (5Z)-5-[(4-methylphenyl)methylidene]imidazolidine-2,4-dione?
(5Z)-5-[(4-methylphenyl)methylidene]imidazolidine-2,4-dione has a molecular weight of 202.21 g/mol, XLogP of 1.18, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z)-5-[(4-methylphenyl)methylidene]imidazolidine-2,4-dione is sourced from PubChem (CID 697033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).