1-(3-chloro-4-methoxyphenyl)imidazolidine-2,4-dione

C10H9ClN2O3 — CID 112724158

IUPAC1-(3-chloro-4-methoxyphenyl)imidazolidine-2,4-dione
SMILESCOc1ccc(N2CC(=O)NC2=O)cc1Cl
InChIInChI=1S/C10H9ClN2O3/c1-16-8-3-2-6(4-7(8)11)13-5-9(14)12-10(13)15/h2-4H,5H2,1H3,(H,12,14,15)
InChIKeyREMXPGQPJYVPIR-UHFFFAOYSA-N
MW240.65 g/mol
LogP1.40
Rot. Bonds2

About 1-(3-chloro-4-methoxyphenyl)imidazolidine-2,4-dione

1-(3-chloro-4-methoxyphenyl)imidazolidine-2,4-dione (PubChem CID 112724158) has the molecular formula C10H9ClN2O3 and a molecular weight of 240.65 g/mol. Its IUPAC name is 1-(3-chloro-4-methoxyphenyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name1-(3-chloro-4-methoxyphenyl)imidazolidine-2,4-dione
PubChem CID112724158
Molecular FormulaC10H9ClN2O3
Molecular Weight240.65 g/mol
Exact Mass240.03
IUPAC Name1-(3-chloro-4-methoxyphenyl)imidazolidine-2,4-dione
SMILESCOc1ccc(N2CC(=O)NC2=O)cc1Cl
InChIInChI=1S/C10H9ClN2O3/c1-16-8-3-2-6(4-7(8)11)13-5-9(14)12-10(13)15/h2-4H,5H2,1H3,(H,12,14,15)
InChIKeyREMXPGQPJYVPIR-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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Related Compounds

1-[4-(3-tert-butyl-4-methoxyphenoxy)-3,5-dichlorophenyl]imidazolidine-2,4-dione
CID 24785831
1-(2,5-dimethoxyphenyl)imidazolidine-2,4-dione
CID 4770213
1-(4-chlorophenyl)imidazolidine-2,4-dione;ethane
CID 177019108
5-[2,6-dichloro-4-(2,4-dioxoimidazolidin-1-yl)phenoxy]-2-methoxy-N,N-dimethylbenzenesulfonamide
CID 24786094
1-(2-chloro-5-methoxyphenyl)imidazolidine-2,4-dione
CID 79777385
4-(3-chloro-4-methoxyphenyl)-1,4-diazocan-5-one
CID 117015374
1-(6-methoxy-3-pyridinyl)imidazolidine-2,4-dione
CID 139347892
1-(3-chloro-4-methoxyphenyl)-5,5-dimethyl-1,3-diazinane-2,4,6-trione
CID 115946399
1-(3-chloro-4-methoxyphenyl)-2-oxoazetidine-3-carboxylic acid
CID 82482397
2-(3-chloro-4-methoxyphenyl)-1,3-dihydroisoindole
CID 894282
1-(3-chloro-4-methoxyphenyl)-4-(hydroxymethyl)-4-methylpyrazolidin-3-one
CID 91740108
2-(3-chloro-4-methoxyphenyl)-1,2,5-thiadiazolidine 1,1-dioxide
CID 117003011

Frequently Asked Questions

What is the IUPAC name of 1-(3-chloro-4-methoxyphenyl)imidazolidine-2,4-dione?
The IUPAC name of 1-(3-chloro-4-methoxyphenyl)imidazolidine-2,4-dione (CID 112724158) is 1-(3-chloro-4-methoxyphenyl)imidazolidine-2,4-dione.
What is the SMILES notation for 1-(3-chloro-4-methoxyphenyl)imidazolidine-2,4-dione?
The canonical SMILES for 1-(3-chloro-4-methoxyphenyl)imidazolidine-2,4-dione is COc1ccc(N2CC(=O)NC2=O)cc1Cl.
What is the InChIKey of 1-(3-chloro-4-methoxyphenyl)imidazolidine-2,4-dione?
The InChIKey is REMXPGQPJYVPIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClN2O3/c1-16-8-3-2-6(4-7(8)11)13-5-9(14)12-10(13)15/h2-4H,5H2,1H3,(H,12,14,15).
What are the key properties of 1-(3-chloro-4-methoxyphenyl)imidazolidine-2,4-dione?
1-(3-chloro-4-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-(3-chloro-4-methoxyphenyl)imidazolidine-2,4-dione is sourced from PubChem (CID 112724158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).