1-(2,3-dichlorophenyl)sulfonylpiperidine

C11H13Cl2NO2S — CID 691910

IUPAC1-(2,3-dichlorophenyl)sulfonylpiperidine
SMILESO=S(=O)(c1cccc(Cl)c1Cl)N1CCCCC1
InChIInChI=1S/C11H13Cl2NO2S/c12-9-5-4-6-10(11(9)13)17(15,16)14-7-2-1-3-8-14/h4-6H,1-3,7-8H2
InChIKeyBDWQNWHYBAQWCN-UHFFFAOYSA-N
MW294.20 g/mol
LogP3.17
Rot. Bonds2

About 1-(2,3-dichlorophenyl)sulfonylpiperidine

1-(2,3-dichlorophenyl)sulfonylpiperidine (PubChem CID 691910) has the molecular formula C11H13Cl2NO2S and a molecular weight of 294.20 g/mol. Its IUPAC name is 1-(2,3-dichlorophenyl)sulfonylpiperidine.

Molecular Properties

Compound Name1-(2,3-dichlorophenyl)sulfonylpiperidine
PubChem CID691910
Molecular FormulaC11H13Cl2NO2S
Molecular Weight294.20 g/mol
Exact Mass293.00
IUPAC Name1-(2,3-dichlorophenyl)sulfonylpiperidine
SMILESO=S(=O)(c1cccc(Cl)c1Cl)N1CCCCC1
InChIInChI=1S/C11H13Cl2NO2S/c12-9-5-4-6-10(11(9)13)17(15,16)14-7-2-1-3-8-14/h4-6H,1-3,7-8H2
InChIKeyBDWQNWHYBAQWCN-UHFFFAOYSA-N
XLogP3.17
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.20
LogP ≤ 53.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-(2,3-dichlorophenyl)sulfonylpiperidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Piperidine, 1-[(2,5-dichlorophenyl)sulfonyl]-
CID 646492
1-[(2,5-Dichlorophenyl)sulfonyl]pyrrolidine
CID 767694
1-[(2,5-Dichlorophenyl)sulfonyl]-3-methylpiperidine
CID 2806415
1-(3-Chlorophenyl)sulfonylpyrrolidine
CID 890981
3,4-dichloro-N,N-dimethylbenzenesulfonamide
CID 4176410
3-[4-(2,5-Dichlorophenyl)sulfonylpiperazin-1-yl]propanenitrile
CID 2576672
1-(2,3-Dichlorophenyl)sulfonyl-4-methyl-1,4-diazepane;hydrochloride
CID 16196895
1-(2,5-Dichloro benzene)-sulfonyl-cis-2,6-dimethyl piperidine
CID 44245424
3-chloro-N-methyl-N-(1-methylpiperidin-4-yl)benzenesulfonamide
CID 57395160
Piperidine, 1-[(4-chlorophenyl)sulfonyl]-
CID 965266
1-(3,4-Dichlorobenzenesulfonyl)piperazine
CID 2565881
2-chloro-N-methyl-N-(1-methylpiperidin-4-yl)benzenesulfonamide
CID 57403903

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dichlorophenyl)sulfonylpiperidine?
The IUPAC name of 1-(2,3-dichlorophenyl)sulfonylpiperidine (CID 691910) is 1-(2,3-dichlorophenyl)sulfonylpiperidine.
What is the SMILES notation for 1-(2,3-dichlorophenyl)sulfonylpiperidine?
The canonical SMILES for 1-(2,3-dichlorophenyl)sulfonylpiperidine is O=S(=O)(c1cccc(Cl)c1Cl)N1CCCCC1.
What is the InChIKey of 1-(2,3-dichlorophenyl)sulfonylpiperidine?
The InChIKey is BDWQNWHYBAQWCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13Cl2NO2S/c12-9-5-4-6-10(11(9)13)17(15,16)14-7-2-1-3-8-14/h4-6H,1-3,7-8H2.
What are the key properties of 1-(2,3-dichlorophenyl)sulfonylpiperidine?
1-(2,3-dichlorophenyl)sulfonylpiperidine has a molecular weight of 294.20 g/mol, XLogP of 3.17, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dichlorophenyl)sulfonylpiperidine is sourced from PubChem (CID 691910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).