5-(2-chlorobenzoyl)imidazolidine-2,4-dione

C10H7ClN2O3 — CID 174599084

IUPAC5-(2-chlorobenzoyl)imidazolidine-2,4-dione
SMILESO=C1NC(=O)C(C(=O)c2ccccc2Cl)N1
InChIInChI=1S/C10H7ClN2O3/c11-6-4-2-1-3-5(6)8(14)7-9(15)13-10(16)12-7/h1-4,7H,(H2,12,13,15,16)
InChIKeyOCAJRSBELBDBBT-UHFFFAOYSA-N
MW238.63 g/mol
LogP0.73
Rot. Bonds2

About 5-(2-chlorobenzoyl)imidazolidine-2,4-dione

5-(2-chlorobenzoyl)imidazolidine-2,4-dione (PubChem CID 174599084) has the molecular formula C10H7ClN2O3 and a molecular weight of 238.63 g/mol. Its IUPAC name is 5-(2-chlorobenzoyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name5-(2-chlorobenzoyl)imidazolidine-2,4-dione
PubChem CID174599084
Molecular FormulaC10H7ClN2O3
Molecular Weight238.63 g/mol
Exact Mass238.01
IUPAC Name5-(2-chlorobenzoyl)imidazolidine-2,4-dione
SMILESO=C1NC(=O)C(C(=O)c2ccccc2Cl)N1
InChIInChI=1S/C10H7ClN2O3/c11-6-4-2-1-3-5(6)8(14)7-9(15)13-10(16)12-7/h1-4,7H,(H2,12,13,15,16)
InChIKeyOCAJRSBELBDBBT-UHFFFAOYSA-N
XLogP0.73
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.63
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Related Compounds

(2-aminocycloheptyl)-(2-chlorophenyl)methanone
CID 116595085
(2-aminocyclopentyl)-(2-chlorophenyl)methanone
CID 116580051
2-chloro-N-[2-[3-[(4R)-2,5-dioxoimidazolidin-4-yl]propanoylamino]ethyl]benzamide
CID 97128970
4-(2-chlorobenzoyl)-3-methyl-4H-1,2-oxazol-5-one
CID 72708489
2-(2-chlorobenzoyl)cyclohexane-1,3-dione
CID 14301628
5-[(2-chlorophenyl)methyl]-1,3-diazinane-2,4,6-trione
CID 67491988
3-bicyclo[3.1.0]hexanyl-(2-chlorophenyl)methanone
CID 114963326
(2-chlorophenyl)-(5-oxaspiro[3.5]nonan-8-yl)methanone
CID 79922324
5-[2-(2-chlorophenyl)ethynyl]imidazolidine-2,4-dione
CID 143512660
1-(2-chlorophenyl)ethanone;hydrochloride
CID 174743581
(2-chlorophenyl)-(3-methylcyclopentyl)methanone
CID 65402941
(2-chlorophenyl)-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanone
CID 112680607

Frequently Asked Questions

What is the IUPAC name of 5-(2-chlorobenzoyl)imidazolidine-2,4-dione?
The IUPAC name of 5-(2-chlorobenzoyl)imidazolidine-2,4-dione (CID 174599084) is 5-(2-chlorobenzoyl)imidazolidine-2,4-dione.
What is the SMILES notation for 5-(2-chlorobenzoyl)imidazolidine-2,4-dione?
The canonical SMILES for 5-(2-chlorobenzoyl)imidazolidine-2,4-dione is O=C1NC(=O)C(C(=O)c2ccccc2Cl)N1.
What is the InChIKey of 5-(2-chlorobenzoyl)imidazolidine-2,4-dione?
The InChIKey is OCAJRSBELBDBBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7ClN2O3/c11-6-4-2-1-3-5(6)8(14)7-9(15)13-10(16)12-7/h1-4,7H,(H2,12,13,15,16).
What are the key properties of 5-(2-chlorobenzoyl)imidazolidine-2,4-dione?
5-(2-chlorobenzoyl)imidazolidine-2,4-dione has a molecular weight of 238.63 g/mol, XLogP of 0.73, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-chlorobenzoyl)imidazolidine-2,4-dione is sourced from PubChem (CID 174599084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).