1-(4-chlorophenyl)sulfonylimidazolidin-2-one

C9H9ClN2O3S — CID 1263202

IUPAC1-(4-chlorophenyl)sulfonylimidazolidin-2-one
SMILESO=C1NCCN1S(=O)(=O)c1ccc(Cl)cc1
InChIInChI=1S/C9H9ClN2O3S/c10-7-1-3-8(4-2-7)16(14,15)12-6-5-11-9(12)13/h1-4H,5-6H2,(H,11,13)
InChIKeyQMNPVVISGDODBE-UHFFFAOYSA-N
MW260.70 g/mol
LogP1.05
Rot. Bonds2

About 1-(4-chlorophenyl)sulfonylimidazolidin-2-one

1-(4-chlorophenyl)sulfonylimidazolidin-2-one (PubChem CID 1263202) has the molecular formula C9H9ClN2O3S and a molecular weight of 260.70 g/mol. Its IUPAC name is 1-(4-chlorophenyl)sulfonylimidazolidin-2-one.

Molecular Properties

Compound Name1-(4-chlorophenyl)sulfonylimidazolidin-2-one
PubChem CID1263202
Molecular FormulaC9H9ClN2O3S
Molecular Weight260.70 g/mol
Exact Mass260.00
IUPAC Name1-(4-chlorophenyl)sulfonylimidazolidin-2-one
SMILESO=C1NCCN1S(=O)(=O)c1ccc(Cl)cc1
InChIInChI=1S/C9H9ClN2O3S/c10-7-1-3-8(4-2-7)16(14,15)12-6-5-11-9(12)13/h1-4H,5-6H2,(H,11,13)
InChIKeyQMNPVVISGDODBE-UHFFFAOYSA-N
XLogP1.05
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.70
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)sulfonylimidazolidin-2-one?
The IUPAC name of 1-(4-chlorophenyl)sulfonylimidazolidin-2-one (CID 1263202) is 1-(4-chlorophenyl)sulfonylimidazolidin-2-one.
What is the SMILES notation for 1-(4-chlorophenyl)sulfonylimidazolidin-2-one?
The canonical SMILES for 1-(4-chlorophenyl)sulfonylimidazolidin-2-one is O=C1NCCN1S(=O)(=O)c1ccc(Cl)cc1.
What is the InChIKey of 1-(4-chlorophenyl)sulfonylimidazolidin-2-one?
The InChIKey is QMNPVVISGDODBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9ClN2O3S/c10-7-1-3-8(4-2-7)16(14,15)12-6-5-11-9(12)13/h1-4H,5-6H2,(H,11,13).
What are the key properties of 1-(4-chlorophenyl)sulfonylimidazolidin-2-one?
1-(4-chlorophenyl)sulfonylimidazolidin-2-one has a molecular weight of 260.70 g/mol, XLogP of 1.05, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)sulfonylimidazolidin-2-one is sourced from PubChem (CID 1263202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).