5-[(2,6-dichlorophenoxy)methyl]-5-methylimidazolidine-2,4-dione

C11H10Cl2N2O3 — CID 4143312

IUPAC5-[(2,6-dichlorophenoxy)methyl]-5-methylimidazolidine-2,4-dione
SMILESCC1(COc2c(Cl)cccc2Cl)NC(=O)NC1=O
InChIInChI=1S/C11H10Cl2N2O3/c1-11(9(16)14-10(17)15-11)5-18-8-6(12)3-2-4-7(8)13/h2-4H,5H2,1H3,(H2,14,15,16,17)
InChIKeyLFWKPMJWBIANPO-UHFFFAOYSA-N
MW289.12 g/mol
LogP1.97
Rot. Bonds3

About 5-[(2,6-dichlorophenoxy)methyl]-5-methylimidazolidine-2,4-dione

5-[(2,6-dichlorophenoxy)methyl]-5-methylimidazolidine-2,4-dione (PubChem CID 4143312) has the molecular formula C11H10Cl2N2O3 and a molecular weight of 289.12 g/mol. Its IUPAC name is 5-[(2,6-dichlorophenoxy)methyl]-5-methylimidazolidine-2,4-dione.

Molecular Properties

Compound Name5-[(2,6-dichlorophenoxy)methyl]-5-methylimidazolidine-2,4-dione
PubChem CID4143312
Molecular FormulaC11H10Cl2N2O3
Molecular Weight289.12 g/mol
Exact Mass288.01
IUPAC Name5-[(2,6-dichlorophenoxy)methyl]-5-methylimidazolidine-2,4-dione
SMILESCC1(COc2c(Cl)cccc2Cl)NC(=O)NC1=O
InChIInChI=1S/C11H10Cl2N2O3/c1-11(9(16)14-10(17)15-11)5-18-8-6(12)3-2-4-7(8)13/h2-4H,5H2,1H3,(H2,14,15,16,17)
InChIKeyLFWKPMJWBIANPO-UHFFFAOYSA-N
XLogP1.97
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.12
LogP ≤ 51.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-[(2,6-dichlorophenoxy)methyl]-5-methylimidazolidine-2,4-dione?
The IUPAC name of 5-[(2,6-dichlorophenoxy)methyl]-5-methylimidazolidine-2,4-dione (CID 4143312) is 5-[(2,6-dichlorophenoxy)methyl]-5-methylimidazolidine-2,4-dione.
What is the SMILES notation for 5-[(2,6-dichlorophenoxy)methyl]-5-methylimidazolidine-2,4-dione?
The canonical SMILES for 5-[(2,6-dichlorophenoxy)methyl]-5-methylimidazolidine-2,4-dione is CC1(COc2c(Cl)cccc2Cl)NC(=O)NC1=O.
What is the InChIKey of 5-[(2,6-dichlorophenoxy)methyl]-5-methylimidazolidine-2,4-dione?
The InChIKey is LFWKPMJWBIANPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10Cl2N2O3/c1-11(9(16)14-10(17)15-11)5-18-8-6(12)3-2-4-7(8)13/h2-4H,5H2,1H3,(H2,14,15,16,17).
What are the key properties of 5-[(2,6-dichlorophenoxy)methyl]-5-methylimidazolidine-2,4-dione?
5-[(2,6-dichlorophenoxy)methyl]-5-methylimidazolidine-2,4-dione has a molecular weight of 289.12 g/mol, XLogP of 1.97, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2,6-dichlorophenoxy)methyl]-5-methylimidazolidine-2,4-dione is sourced from PubChem (CID 4143312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).