2,6-dimethyl-1-(2-methylpyrazol-3-yl)sulfonylpiperazine

C10H18N4O2S — CID 104710257

IUPAC2,6-dimethyl-1-(2-methylpyrazol-3-yl)sulfonylpiperazine
SMILESCC1CNCC(C)N1S(=O)(=O)c1ccnn1C
InChIInChI=1S/C10H18N4O2S/c1-8-6-11-7-9(2)14(8)17(15,16)10-4-5-12-13(10)3/h4-5,8-9,11H,6-7H2,1-3H3
InChIKeyUUPNYBLXTACHLJ-UHFFFAOYSA-N
MW258.35 g/mol
LogP-0.21
Rot. Bonds2

About 2,6-dimethyl-1-(2-methylpyrazol-3-yl)sulfonylpiperazine

2,6-dimethyl-1-(2-methylpyrazol-3-yl)sulfonylpiperazine (PubChem CID 104710257) has the molecular formula C10H18N4O2S and a molecular weight of 258.35 g/mol. Its IUPAC name is 2,6-dimethyl-1-(2-methylpyrazol-3-yl)sulfonylpiperazine.

Molecular Properties

Compound Name2,6-dimethyl-1-(2-methylpyrazol-3-yl)sulfonylpiperazine
PubChem CID104710257
Molecular FormulaC10H18N4O2S
Molecular Weight258.35 g/mol
Exact Mass258.12
IUPAC Name2,6-dimethyl-1-(2-methylpyrazol-3-yl)sulfonylpiperazine
SMILESCC1CNCC(C)N1S(=O)(=O)c1ccnn1C
InChIInChI=1S/C10H18N4O2S/c1-8-6-11-7-9(2)14(8)17(15,16)10-4-5-12-13(10)3/h4-5,8-9,11H,6-7H2,1-3H3
InChIKeyUUPNYBLXTACHLJ-UHFFFAOYSA-N
XLogP-0.21
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.35
LogP ≤ 5-0.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-1-(2-methylpyrazol-3-yl)sulfonylpiperazine?
The IUPAC name of 2,6-dimethyl-1-(2-methylpyrazol-3-yl)sulfonylpiperazine (CID 104710257) is 2,6-dimethyl-1-(2-methylpyrazol-3-yl)sulfonylpiperazine.
What is the SMILES notation for 2,6-dimethyl-1-(2-methylpyrazol-3-yl)sulfonylpiperazine?
The canonical SMILES for 2,6-dimethyl-1-(2-methylpyrazol-3-yl)sulfonylpiperazine is CC1CNCC(C)N1S(=O)(=O)c1ccnn1C.
What is the InChIKey of 2,6-dimethyl-1-(2-methylpyrazol-3-yl)sulfonylpiperazine?
The InChIKey is UUPNYBLXTACHLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O2S/c1-8-6-11-7-9(2)14(8)17(15,16)10-4-5-12-13(10)3/h4-5,8-9,11H,6-7H2,1-3H3.
What are the key properties of 2,6-dimethyl-1-(2-methylpyrazol-3-yl)sulfonylpiperazine?
2,6-dimethyl-1-(2-methylpyrazol-3-yl)sulfonylpiperazine has a molecular weight of 258.35 g/mol, XLogP of -0.21, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-1-(2-methylpyrazol-3-yl)sulfonylpiperazine is sourced from PubChem (CID 104710257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).