N-(1-hydroxypropan-2-yl)-N,2-dimethylpyrazole-3-sulfonamide

C8H15N3O3S — CID 104710142

IUPACN-(1-hydroxypropan-2-yl)-N,2-dimethylpyrazole-3-sulfonamide
SMILESCC(CO)N(C)S(=O)(=O)c1ccnn1C
InChIInChI=1S/C8H15N3O3S/c1-7(6-12)11(3)15(13,14)8-4-5-9-10(8)2/h4-5,7,12H,6H2,1-3H3
InChIKeyIZDJBLOEJPYAEK-UHFFFAOYSA-N
MW233.29 g/mol
LogP-0.58
Rot. Bonds4

About N-(1-hydroxypropan-2-yl)-N,2-dimethylpyrazole-3-sulfonamide

N-(1-hydroxypropan-2-yl)-N,2-dimethylpyrazole-3-sulfonamide (PubChem CID 104710142) has the molecular formula C8H15N3O3S and a molecular weight of 233.29 g/mol. Its IUPAC name is N-(1-hydroxypropan-2-yl)-N,2-dimethylpyrazole-3-sulfonamide.

Molecular Properties

Compound NameN-(1-hydroxypropan-2-yl)-N,2-dimethylpyrazole-3-sulfonamide
PubChem CID104710142
Molecular FormulaC8H15N3O3S
Molecular Weight233.29 g/mol
Exact Mass233.08
IUPAC NameN-(1-hydroxypropan-2-yl)-N,2-dimethylpyrazole-3-sulfonamide
SMILESCC(CO)N(C)S(=O)(=O)c1ccnn1C
InChIInChI=1S/C8H15N3O3S/c1-7(6-12)11(3)15(13,14)8-4-5-9-10(8)2/h4-5,7,12H,6H2,1-3H3
InChIKeyIZDJBLOEJPYAEK-UHFFFAOYSA-N
XLogP-0.58
TPSA75.43 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.29
LogP ≤ 5-0.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1-aminopropan-2-yl)-N,2-dimethylpyrazole-3-sulfonamide;hydrochloride
CID 120710548
2-methyl-3-[methyl-(2-methylpyrazol-3-yl)sulfonylamino]propanoic acid
CID 104709586
N-(1-hydroxypropan-2-yl)-2-methylpyrazole-3-sulfonamide
CID 104710044
N-(3-amino-2-methylpropyl)-N,2-dimethylpyrazole-3-sulfonamide
CID 104709309
N-[(2R)-1-hydroxybutan-2-yl]-2-methylpyrazole-3-sulfonamide
CID 104773164
N-(2-bromo-3-methoxypropyl)-N,2-dimethylpyrazole-3-sulfonamide
CID 104710609
methyl 2-[(2-methoxy-2-oxoethyl)-(2-methylpyrazol-3-yl)sulfonylamino]acetate
CID 104710370
N-(1-hydroxypropan-2-yl)-N,2-dimethylbenzenesulfonamide
CID 115875785
N-(1-hydroxypropan-2-yl)-N-methylmethanesulfonamide
CID 87281445
N-cyclobutyl-N-(3-hydroxypropyl)-2-methylpyrazole-3-sulfonamide
CID 102847530
methyl 2-[(2-methylpyrazol-3-yl)sulfonyl-propylamino]acetate
CID 104710365
N-(1-hydroxypentan-3-yl)-2-methylpyrazole-3-sulfonamide
CID 104773039

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxypropan-2-yl)-N,2-dimethylpyrazole-3-sulfonamide?
The IUPAC name of N-(1-hydroxypropan-2-yl)-N,2-dimethylpyrazole-3-sulfonamide (CID 104710142) is N-(1-hydroxypropan-2-yl)-N,2-dimethylpyrazole-3-sulfonamide.
What is the SMILES notation for N-(1-hydroxypropan-2-yl)-N,2-dimethylpyrazole-3-sulfonamide?
The canonical SMILES for N-(1-hydroxypropan-2-yl)-N,2-dimethylpyrazole-3-sulfonamide is CC(CO)N(C)S(=O)(=O)c1ccnn1C.
What is the InChIKey of N-(1-hydroxypropan-2-yl)-N,2-dimethylpyrazole-3-sulfonamide?
The InChIKey is IZDJBLOEJPYAEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3O3S/c1-7(6-12)11(3)15(13,14)8-4-5-9-10(8)2/h4-5,7,12H,6H2,1-3H3.
What are the key properties of N-(1-hydroxypropan-2-yl)-N,2-dimethylpyrazole-3-sulfonamide?
N-(1-hydroxypropan-2-yl)-N,2-dimethylpyrazole-3-sulfonamide has a molecular weight of 233.29 g/mol, XLogP of -0.58, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxypropan-2-yl)-N,2-dimethylpyrazole-3-sulfonamide is sourced from PubChem (CID 104710142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).