2-methyl-1-(2-methylpyrazol-3-yl)sulfonylpiperazine

C9H16N4O2S — CID 104710234

IUPAC2-methyl-1-(2-methylpyrazol-3-yl)sulfonylpiperazine
SMILESCC1CNCCN1S(=O)(=O)c1ccnn1C
InChIInChI=1S/C9H16N4O2S/c1-8-7-10-5-6-13(8)16(14,15)9-3-4-11-12(9)2/h3-4,8,10H,5-7H2,1-2H3
InChIKeyKQFBBUDKTVYRML-UHFFFAOYSA-N
MW244.32 g/mol
LogP-0.60
Rot. Bonds2

About 2-methyl-1-(2-methylpyrazol-3-yl)sulfonylpiperazine

2-methyl-1-(2-methylpyrazol-3-yl)sulfonylpiperazine (PubChem CID 104710234) has the molecular formula C9H16N4O2S and a molecular weight of 244.32 g/mol. Its IUPAC name is 2-methyl-1-(2-methylpyrazol-3-yl)sulfonylpiperazine.

Molecular Properties

Compound Name2-methyl-1-(2-methylpyrazol-3-yl)sulfonylpiperazine
PubChem CID104710234
Molecular FormulaC9H16N4O2S
Molecular Weight244.32 g/mol
Exact Mass244.10
IUPAC Name2-methyl-1-(2-methylpyrazol-3-yl)sulfonylpiperazine
SMILESCC1CNCCN1S(=O)(=O)c1ccnn1C
InChIInChI=1S/C9H16N4O2S/c1-8-7-10-5-6-13(8)16(14,15)9-3-4-11-12(9)2/h3-4,8,10H,5-7H2,1-2H3
InChIKeyKQFBBUDKTVYRML-UHFFFAOYSA-N
XLogP-0.60
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.32
LogP ≤ 5-0.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2,6-dimethyl-1-(2-methylpyrazol-3-yl)sulfonylpiperazine
CID 104710257
3-methyl-4-(2-methylpyrazol-3-yl)sulfonylpiperazin-2-one
CID 104710168
(3S)-4-(2-methylpyrazol-3-yl)sulfonyl-3-propan-2-ylpiperazin-2-one
CID 164634207
(2S)-1-(4-iodophenyl)sulfonyl-2-methylpiperazine
CID 82755760
(2R)-2-methyl-1-(4-methylsulfonylphenyl)sulfonylpiperazine;hydrochloride
CID 120716978
(2S)-1-(3,5-difluorophenyl)sulfonyl-2-methylpiperazine
CID 82756368
2-methyl-1-(4-methylphenyl)sulfonylpiperazine;hydrochloride
CID 119969701
(2S)-1-[(3-chloro-2-pyridinyl)sulfonyl]-2-methylpiperazine
CID 97163398
(2R)-1-(3,5-difluorophenyl)sulfonyl-2-methylpiperazine;hydrochloride
CID 120716849
2-[1-(2-methylpyrazol-3-yl)sulfonyl-3-oxopiperazin-2-yl]acetic acid
CID 104709647
1-(1,2-dimethylimidazol-4-yl)sulfonyl-2-methylpiperazine;hydrochloride
CID 119969883
(2S)-2-methyl-1-(1-methylimidazol-4-yl)sulfonylpiperazine;hydrochloride
CID 120717155

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(2-methylpyrazol-3-yl)sulfonylpiperazine?
The IUPAC name of 2-methyl-1-(2-methylpyrazol-3-yl)sulfonylpiperazine (CID 104710234) is 2-methyl-1-(2-methylpyrazol-3-yl)sulfonylpiperazine.
What is the SMILES notation for 2-methyl-1-(2-methylpyrazol-3-yl)sulfonylpiperazine?
The canonical SMILES for 2-methyl-1-(2-methylpyrazol-3-yl)sulfonylpiperazine is CC1CNCCN1S(=O)(=O)c1ccnn1C.
What is the InChIKey of 2-methyl-1-(2-methylpyrazol-3-yl)sulfonylpiperazine?
The InChIKey is KQFBBUDKTVYRML-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4O2S/c1-8-7-10-5-6-13(8)16(14,15)9-3-4-11-12(9)2/h3-4,8,10H,5-7H2,1-2H3.
What are the key properties of 2-methyl-1-(2-methylpyrazol-3-yl)sulfonylpiperazine?
2-methyl-1-(2-methylpyrazol-3-yl)sulfonylpiperazine has a molecular weight of 244.32 g/mol, XLogP of -0.60, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(2-methylpyrazol-3-yl)sulfonylpiperazine is sourced from PubChem (CID 104710234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).