1-(2,6-difluorophenyl)sulfonylpiperazine

C10H12F2N2O2S — CID 2405183

IUPAC1-(2,6-difluorophenyl)sulfonylpiperazine
SMILESO=S(=O)(c1c(F)cccc1F)N1CCNCC1
InChIInChI=1S/C10H12F2N2O2S/c11-8-2-1-3-9(12)10(8)17(15,16)14-6-4-13-5-7-14/h1-3,13H,4-7H2
InChIKeyPZSLKDVSXVWFMI-UHFFFAOYSA-N
MW262.28 g/mol
LogP0.56
Rot. Bonds2

About 1-(2,6-difluorophenyl)sulfonylpiperazine

1-(2,6-difluorophenyl)sulfonylpiperazine (PubChem CID 2405183) has the molecular formula C10H12F2N2O2S and a molecular weight of 262.28 g/mol. Its IUPAC name is 1-(2,6-difluorophenyl)sulfonylpiperazine.

Molecular Properties

Compound Name1-(2,6-difluorophenyl)sulfonylpiperazine
PubChem CID2405183
Molecular FormulaC10H12F2N2O2S
Molecular Weight262.28 g/mol
Exact Mass262.06
IUPAC Name1-(2,6-difluorophenyl)sulfonylpiperazine
SMILESO=S(=O)(c1c(F)cccc1F)N1CCNCC1
InChIInChI=1S/C10H12F2N2O2S/c11-8-2-1-3-9(12)10(8)17(15,16)14-6-4-13-5-7-14/h1-3,13H,4-7H2
InChIKeyPZSLKDVSXVWFMI-UHFFFAOYSA-N
XLogP0.56
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.28
LogP ≤ 50.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(2,6-difluorophenyl)sulfonylpiperazine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(2,6-difluorophenyl)sulfonylpiperazine?
The IUPAC name of 1-(2,6-difluorophenyl)sulfonylpiperazine (CID 2405183) is 1-(2,6-difluorophenyl)sulfonylpiperazine.
What is the SMILES notation for 1-(2,6-difluorophenyl)sulfonylpiperazine?
The canonical SMILES for 1-(2,6-difluorophenyl)sulfonylpiperazine is O=S(=O)(c1c(F)cccc1F)N1CCNCC1.
What is the InChIKey of 1-(2,6-difluorophenyl)sulfonylpiperazine?
The InChIKey is PZSLKDVSXVWFMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F2N2O2S/c11-8-2-1-3-9(12)10(8)17(15,16)14-6-4-13-5-7-14/h1-3,13H,4-7H2.
What are the key properties of 1-(2,6-difluorophenyl)sulfonylpiperazine?
1-(2,6-difluorophenyl)sulfonylpiperazine has a molecular weight of 262.28 g/mol, XLogP of 0.56, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-difluorophenyl)sulfonylpiperazine is sourced from PubChem (CID 2405183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).