2-methyl-N-pyrrolidin-3-ylpyrazole-3-sulfonamide

C8H14N4O2S — CID 104709475

IUPAC2-methyl-N-pyrrolidin-3-ylpyrazole-3-sulfonamide
SMILESCn1nccc1S(=O)(=O)NC1CCNC1
InChIInChI=1S/C8H14N4O2S/c1-12-8(3-5-10-12)15(13,14)11-7-2-4-9-6-7/h3,5,7,9,11H,2,4,6H2,1H3
InChIKeyJDXPUYWWPLNKBI-UHFFFAOYSA-N
MW230.29 g/mol
LogP-0.94
Rot. Bonds3

About 2-methyl-N-pyrrolidin-3-ylpyrazole-3-sulfonamide

2-methyl-N-pyrrolidin-3-ylpyrazole-3-sulfonamide (PubChem CID 104709475) has the molecular formula C8H14N4O2S and a molecular weight of 230.29 g/mol. Its IUPAC name is 2-methyl-N-pyrrolidin-3-ylpyrazole-3-sulfonamide.

Molecular Properties

Compound Name2-methyl-N-pyrrolidin-3-ylpyrazole-3-sulfonamide
PubChem CID104709475
Molecular FormulaC8H14N4O2S
Molecular Weight230.29 g/mol
Exact Mass230.08
IUPAC Name2-methyl-N-pyrrolidin-3-ylpyrazole-3-sulfonamide
SMILESCn1nccc1S(=O)(=O)NC1CCNC1
InChIInChI=1S/C8H14N4O2S/c1-12-8(3-5-10-12)15(13,14)11-7-2-4-9-6-7/h3,5,7,9,11H,2,4,6H2,1H3
InChIKeyJDXPUYWWPLNKBI-UHFFFAOYSA-N
XLogP-0.94
TPSA76.02 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.29
LogP ≤ 5-0.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclopentyl-2-methylpyrazole-3-sulfonamide
CID 104709770
2-methyl-N-(1-pyrrolidin-3-ylethyl)pyrazole-3-sulfonamide
CID 104709488
N-(4-aminocyclohexyl)-2-methylpyrazole-3-sulfonamide;hydrochloride
CID 120708226
N-[4-(bromomethyl)cyclohexyl]-2-methylpyrazole-3-sulfonamide
CID 112753047
N,2-dimethyl-N-pyrrolidin-3-ylpyrazole-3-sulfonamide;hydrochloride
CID 120709852
methyl 4-[(2-methylpyrazol-3-yl)sulfonylamino]cyclohexane-1-carboxylate
CID 104710389
N-[1-(cyanomethyl)piperidin-4-yl]-2-methylpyrazole-3-sulfonamide
CID 104709882
3-methyl-N-[(3S)-pyrrolidin-3-yl]pyrazine-2-sulfonamide
CID 71638162
N-(2-aminocyclohexyl)-2-methylpyrazole-3-sulfonamide
CID 113443991
4-methyl-N-[(3R)-pyrrolidin-3-yl]pyrimidine-2-sulfonamide
CID 71638955
N-[(3S)-pyrrolidin-3-yl]benzenesulfonamide
CID 79685431
1,3,5-trimethyl-N-[(3S)-pyrrolidin-3-yl]pyrazole-4-sulfonamide
CID 79684858

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-pyrrolidin-3-ylpyrazole-3-sulfonamide?
The IUPAC name of 2-methyl-N-pyrrolidin-3-ylpyrazole-3-sulfonamide (CID 104709475) is 2-methyl-N-pyrrolidin-3-ylpyrazole-3-sulfonamide.
What is the SMILES notation for 2-methyl-N-pyrrolidin-3-ylpyrazole-3-sulfonamide?
The canonical SMILES for 2-methyl-N-pyrrolidin-3-ylpyrazole-3-sulfonamide is Cn1nccc1S(=O)(=O)NC1CCNC1.
What is the InChIKey of 2-methyl-N-pyrrolidin-3-ylpyrazole-3-sulfonamide?
The InChIKey is JDXPUYWWPLNKBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4O2S/c1-12-8(3-5-10-12)15(13,14)11-7-2-4-9-6-7/h3,5,7,9,11H,2,4,6H2,1H3.
What are the key properties of 2-methyl-N-pyrrolidin-3-ylpyrazole-3-sulfonamide?
2-methyl-N-pyrrolidin-3-ylpyrazole-3-sulfonamide has a molecular weight of 230.29 g/mol, XLogP of -0.94, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-pyrrolidin-3-ylpyrazole-3-sulfonamide is sourced from PubChem (CID 104709475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).