3,5-dimethyl-N-(2-methylcyclopropyl)-1H-pyrazole-4-sulfonamide

C9H15N3O2S — CID 62409421

IUPAC3,5-dimethyl-N-(2-methylcyclopropyl)-1H-pyrazole-4-sulfonamide
SMILESCc1n[nH]c(C)c1S(=O)(=O)NC1CC1C
InChIInChI=1S/C9H15N3O2S/c1-5-4-8(5)12-15(13,14)9-6(2)10-11-7(9)3/h5,8,12H,4H2,1-3H3,(H,10,11)
InChIKeyYQPJOTOPHRCZRM-UHFFFAOYSA-N
MW229.30 g/mol
LogP0.71
Rot. Bonds3

About 3,5-dimethyl-N-(2-methylcyclopropyl)-1H-pyrazole-4-sulfonamide

3,5-dimethyl-N-(2-methylcyclopropyl)-1H-pyrazole-4-sulfonamide (PubChem CID 62409421) has the molecular formula C9H15N3O2S and a molecular weight of 229.30 g/mol. Its IUPAC name is 3,5-dimethyl-N-(2-methylcyclopropyl)-1H-pyrazole-4-sulfonamide.

Molecular Properties

Compound Name3,5-dimethyl-N-(2-methylcyclopropyl)-1H-pyrazole-4-sulfonamide
PubChem CID62409421
Molecular FormulaC9H15N3O2S
Molecular Weight229.30 g/mol
Exact Mass229.09
IUPAC Name3,5-dimethyl-N-(2-methylcyclopropyl)-1H-pyrazole-4-sulfonamide
SMILESCc1n[nH]c(C)c1S(=O)(=O)NC1CC1C
InChIInChI=1S/C9H15N3O2S/c1-5-4-8(5)12-15(13,14)9-6(2)10-11-7(9)3/h5,8,12H,4H2,1-3H3,(H,10,11)
InChIKeyYQPJOTOPHRCZRM-UHFFFAOYSA-N
XLogP0.71
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.30
LogP ≤ 50.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3,5-dimethyl-N-[(3S,4S)-3-methylpiperidin-4-yl]-1H-pyrazole-4-sulfonamide
CID 124516985
3,5-dimethyl-N-(4-methylpiperidin-3-yl)-1H-pyrazole-4-sulfonamide
CID 63329703
N-[2-(bromomethyl)cyclopentyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide
CID 106367456
3-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]cyclopentane-1-carboxylic acid
CID 66031148
N-(2-methoxycyclopentyl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide
CID 62088808
3,5-dimethyl-N-piperidin-4-yl-1H-pyrazole-4-sulfonamide;hydrochloride
CID 72716268
N-(2,3-dihydro-1H-inden-2-yl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide
CID 104693811
N-(1,1-dioxothiolan-3-yl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide
CID 43237040
4-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]cyclopent-2-ene-1-carboxylic acid
CID 79215852
methyl (2S,4S)-4-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]-1-methylpyrrolidine-2-carboxylate
CID 50959237
N-(3,5-dimethylphenyl)-3,5-dimethyl-1H-pyrazole-4-sulfonamide
CID 866897
3,5-dimethyl-N-[(4-methylpiperidin-3-yl)methyl]-1H-pyrazole-4-sulfonamide
CID 114955864

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-N-(2-methylcyclopropyl)-1H-pyrazole-4-sulfonamide?
The IUPAC name of 3,5-dimethyl-N-(2-methylcyclopropyl)-1H-pyrazole-4-sulfonamide (CID 62409421) is 3,5-dimethyl-N-(2-methylcyclopropyl)-1H-pyrazole-4-sulfonamide.
What is the SMILES notation for 3,5-dimethyl-N-(2-methylcyclopropyl)-1H-pyrazole-4-sulfonamide?
The canonical SMILES for 3,5-dimethyl-N-(2-methylcyclopropyl)-1H-pyrazole-4-sulfonamide is Cc1n[nH]c(C)c1S(=O)(=O)NC1CC1C.
What is the InChIKey of 3,5-dimethyl-N-(2-methylcyclopropyl)-1H-pyrazole-4-sulfonamide?
The InChIKey is YQPJOTOPHRCZRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O2S/c1-5-4-8(5)12-15(13,14)9-6(2)10-11-7(9)3/h5,8,12H,4H2,1-3H3,(H,10,11).
What are the key properties of 3,5-dimethyl-N-(2-methylcyclopropyl)-1H-pyrazole-4-sulfonamide?
3,5-dimethyl-N-(2-methylcyclopropyl)-1H-pyrazole-4-sulfonamide has a molecular weight of 229.30 g/mol, XLogP of 0.71, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-N-(2-methylcyclopropyl)-1H-pyrazole-4-sulfonamide is sourced from PubChem (CID 62409421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).