2-(2,5-dichlorophenyl)sulfonylcyclopentan-1-one

C11H10Cl2O3S — CID 64641762

IUPAC2-(2,5-dichlorophenyl)sulfonylcyclopentan-1-one
SMILESO=C1CCCC1S(=O)(=O)c1cc(Cl)ccc1Cl
InChIInChI=1S/C11H10Cl2O3S/c12-7-4-5-8(13)11(6-7)17(15,16)10-3-1-2-9(10)14/h4-6,10H,1-3H2
InChIKeyMVUFZKAFIYCFGN-UHFFFAOYSA-N
MW293.17 g/mol
LogP2.89
Rot. Bonds2

About 2-(2,5-dichlorophenyl)sulfonylcyclopentan-1-one

2-(2,5-dichlorophenyl)sulfonylcyclopentan-1-one (PubChem CID 64641762) has the molecular formula C11H10Cl2O3S and a molecular weight of 293.17 g/mol. Its IUPAC name is 2-(2,5-dichlorophenyl)sulfonylcyclopentan-1-one.

Molecular Properties

Compound Name2-(2,5-dichlorophenyl)sulfonylcyclopentan-1-one
PubChem CID64641762
Molecular FormulaC11H10Cl2O3S
Molecular Weight293.17 g/mol
Exact Mass291.97
IUPAC Name2-(2,5-dichlorophenyl)sulfonylcyclopentan-1-one
SMILESO=C1CCCC1S(=O)(=O)c1cc(Cl)ccc1Cl
InChIInChI=1S/C11H10Cl2O3S/c12-7-4-5-8(13)11(6-7)17(15,16)10-3-1-2-9(10)14/h4-6,10H,1-3H2
InChIKeyMVUFZKAFIYCFGN-UHFFFAOYSA-N
XLogP2.89
TPSA51.21 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.17
LogP ≤ 52.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-chlorophenyl)sulfonylcyclohexan-1-one
CID 64636185
1-(2,5-dichlorophenyl)sulfonylpyrrolidine
CID 767694
2-(2,5-dichlorophenyl)sulfonylcyclooctan-1-amine
CID 64638826
cyclohexyl 2,5-dichlorobenzenesulfonate
CID 87077276
1-(2,5-dichlorophenyl)sulfonylpyrrolidine-3,4-diol
CID 106672458
1-(2,5-dichlorophenyl)sulfonyl-N-methylpiperidin-4-amine
CID 119979920
1-(2,5-dichlorophenyl)sulfonyl-N-methylpiperidin-3-amine
CID 62536952
2-(2,4-dichlorophenyl)cyclopentan-1-one
CID 130164346
1-(2,5-dichlorophenyl)sulfonyl-4-pyrrolidin-2-ylpiperidine
CID 120714118
5-(2,5-dichlorophenyl)sulfonyl-2,2-dimethylcyclopentan-1-amine
CID 79863760
1-(2,5-dichlorophenyl)sulfonylpiperidine-3-carboxylic acid
CID 2971952
1-[1-(2,5-dichlorophenyl)sulfonylpiperidin-4-yl]ethanol
CID 103834631

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dichlorophenyl)sulfonylcyclopentan-1-one?
The IUPAC name of 2-(2,5-dichlorophenyl)sulfonylcyclopentan-1-one (CID 64641762) is 2-(2,5-dichlorophenyl)sulfonylcyclopentan-1-one.
What is the SMILES notation for 2-(2,5-dichlorophenyl)sulfonylcyclopentan-1-one?
The canonical SMILES for 2-(2,5-dichlorophenyl)sulfonylcyclopentan-1-one is O=C1CCCC1S(=O)(=O)c1cc(Cl)ccc1Cl.
What is the InChIKey of 2-(2,5-dichlorophenyl)sulfonylcyclopentan-1-one?
The InChIKey is MVUFZKAFIYCFGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10Cl2O3S/c12-7-4-5-8(13)11(6-7)17(15,16)10-3-1-2-9(10)14/h4-6,10H,1-3H2.
What are the key properties of 2-(2,5-dichlorophenyl)sulfonylcyclopentan-1-one?
2-(2,5-dichlorophenyl)sulfonylcyclopentan-1-one has a molecular weight of 293.17 g/mol, XLogP of 2.89, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dichlorophenyl)sulfonylcyclopentan-1-one is sourced from PubChem (CID 64641762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).