1-(2-chloro-5-methoxyphenyl)imidazolidine-2,4-dione

C10H9ClN2O3 — CID 79777385

IUPAC1-(2-chloro-5-methoxyphenyl)imidazolidine-2,4-dione
SMILESCOc1ccc(Cl)c(N2CC(=O)NC2=O)c1
InChIInChI=1S/C10H9ClN2O3/c1-16-6-2-3-7(11)8(4-6)13-5-9(14)12-10(13)15/h2-4H,5H2,1H3,(H,12,14,15)
InChIKeyIBSRSURTVRBAJX-UHFFFAOYSA-N
MW240.65 g/mol
LogP1.40
Rot. Bonds2

About 1-(2-chloro-5-methoxyphenyl)imidazolidine-2,4-dione

1-(2-chloro-5-methoxyphenyl)imidazolidine-2,4-dione (PubChem CID 79777385) has the molecular formula C10H9ClN2O3 and a molecular weight of 240.65 g/mol. Its IUPAC name is 1-(2-chloro-5-methoxyphenyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name1-(2-chloro-5-methoxyphenyl)imidazolidine-2,4-dione
PubChem CID79777385
Molecular FormulaC10H9ClN2O3
Molecular Weight240.65 g/mol
Exact Mass240.03
IUPAC Name1-(2-chloro-5-methoxyphenyl)imidazolidine-2,4-dione
SMILESCOc1ccc(Cl)c(N2CC(=O)NC2=O)c1
InChIInChI=1S/C10H9ClN2O3/c1-16-6-2-3-7(11)8(4-6)13-5-9(14)12-10(13)15/h2-4H,5H2,1H3,(H,12,14,15)
InChIKeyIBSRSURTVRBAJX-UHFFFAOYSA-N
XLogP1.40
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.65
LogP ≤ 51.40
H-Bond Donors ≤ 51
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 1-(2-chloro-5-methoxyphenyl)imidazolidine-2,4-dione?
The IUPAC name of 1-(2-chloro-5-methoxyphenyl)imidazolidine-2,4-dione (CID 79777385) is 1-(2-chloro-5-methoxyphenyl)imidazolidine-2,4-dione.
What is the SMILES notation for 1-(2-chloro-5-methoxyphenyl)imidazolidine-2,4-dione?
The canonical SMILES for 1-(2-chloro-5-methoxyphenyl)imidazolidine-2,4-dione is COc1ccc(Cl)c(N2CC(=O)NC2=O)c1.
What is the InChIKey of 1-(2-chloro-5-methoxyphenyl)imidazolidine-2,4-dione?
The InChIKey is IBSRSURTVRBAJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClN2O3/c1-16-6-2-3-7(11)8(4-6)13-5-9(14)12-10(13)15/h2-4H,5H2,1H3,(H,12,14,15).
What are the key properties of 1-(2-chloro-5-methoxyphenyl)imidazolidine-2,4-dione?
1-(2-chloro-5-methoxyphenyl)imidazolidine-2,4-dione has a molecular weight of 240.65 g/mol, XLogP of 1.40, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chloro-5-methoxyphenyl)imidazolidine-2,4-dione is sourced from PubChem (CID 79777385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).