N-[4-(1-hydroxyethyl)phenyl]-2-methylpyrazole-3-sulfonamide

C12H15N3O3S — CID 104710143

IUPACN-[4-(1-hydroxyethyl)phenyl]-2-methylpyrazole-3-sulfonamide
SMILESCC(O)c1ccc(NS(=O)(=O)c2ccnn2C)cc1
InChIInChI=1S/C12H15N3O3S/c1-9(16)10-3-5-11(6-4-10)14-19(17,18)12-7-8-13-15(12)2/h3-9,14,16H,1-2H3
InChIKeyUFUYCEXESCNNTP-UHFFFAOYSA-N
MW281.34 g/mol
LogP1.27
Rot. Bonds4

About N-[4-(1-hydroxyethyl)phenyl]-2-methylpyrazole-3-sulfonamide

N-[4-(1-hydroxyethyl)phenyl]-2-methylpyrazole-3-sulfonamide (PubChem CID 104710143) has the molecular formula C12H15N3O3S and a molecular weight of 281.34 g/mol. Its IUPAC name is N-[4-(1-hydroxyethyl)phenyl]-2-methylpyrazole-3-sulfonamide.

Molecular Properties

Compound NameN-[4-(1-hydroxyethyl)phenyl]-2-methylpyrazole-3-sulfonamide
PubChem CID104710143
Molecular FormulaC12H15N3O3S
Molecular Weight281.34 g/mol
Exact Mass281.08
IUPAC NameN-[4-(1-hydroxyethyl)phenyl]-2-methylpyrazole-3-sulfonamide
SMILESCC(O)c1ccc(NS(=O)(=O)c2ccnn2C)cc1
InChIInChI=1S/C12H15N3O3S/c1-9(16)10-3-5-11(6-4-10)14-19(17,18)12-7-8-13-15(12)2/h3-9,14,16H,1-2H3
InChIKeyUFUYCEXESCNNTP-UHFFFAOYSA-N
XLogP1.27
TPSA84.22 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.34
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[4-(1-hydroxyethyl)phenyl]-2-methylpyrazole-3-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]-5-methyl-1-phenylpyrazole-4-sulfonamide
CID 172437914
1,1,1-Trifluoro-2-[4-[4-(1-methylpyrazol-3-yl)sulfonylpiperazin-1-yl]phenyl]propan-2-ol
CID 144337460
N-[1-(3,4-difluorophenyl)-1-hydroxypropan-2-yl]-1-methylpyrazole-4-sulfonamide
CID 71911229
N-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]-1-methyl-N-(2,2,2-trifluoroethyl)pyrazole-3-sulfonamide
CID 72722947
N-[1-(2-fluorophenyl)-1-hydroxybutan-2-yl]-1-methylpyrazole-4-sulfonamide
CID 75387251
N-[(1R,2S)-1-(3,4-difluorophenyl)-1-hydroxypropan-2-yl]-1-methylpyrazole-4-sulfonamide
CID 97069017
N-[(1R,2R)-1-(3,4-difluorophenyl)-1-hydroxypropan-2-yl]-1-methylpyrazole-4-sulfonamide
CID 97069018
N-[(1S,2S)-1-(3,4-difluorophenyl)-1-hydroxypropan-2-yl]-1-methylpyrazole-4-sulfonamide
CID 97069019
N-[(1S,2R)-1-(3,4-difluorophenyl)-1-hydroxypropan-2-yl]-1-methylpyrazole-4-sulfonamide
CID 97069020
N-[(1R,2S)-1-(2-fluorophenyl)-1-hydroxybutan-2-yl]-1-methylpyrazole-4-sulfonamide
CID 97239572
N-[(1R,2R)-1-(2-fluorophenyl)-1-hydroxybutan-2-yl]-1-methylpyrazole-4-sulfonamide
CID 97239573
N-[(1S,2S)-1-(2-fluorophenyl)-1-hydroxybutan-2-yl]-1-methylpyrazole-4-sulfonamide
CID 97239574

Frequently Asked Questions

What is the IUPAC name of N-[4-(1-hydroxyethyl)phenyl]-2-methylpyrazole-3-sulfonamide?
The IUPAC name of N-[4-(1-hydroxyethyl)phenyl]-2-methylpyrazole-3-sulfonamide (CID 104710143) is N-[4-(1-hydroxyethyl)phenyl]-2-methylpyrazole-3-sulfonamide.
What is the SMILES notation for N-[4-(1-hydroxyethyl)phenyl]-2-methylpyrazole-3-sulfonamide?
The canonical SMILES for N-[4-(1-hydroxyethyl)phenyl]-2-methylpyrazole-3-sulfonamide is CC(O)c1ccc(NS(=O)(=O)c2ccnn2C)cc1.
What is the InChIKey of N-[4-(1-hydroxyethyl)phenyl]-2-methylpyrazole-3-sulfonamide?
The InChIKey is UFUYCEXESCNNTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O3S/c1-9(16)10-3-5-11(6-4-10)14-19(17,18)12-7-8-13-15(12)2/h3-9,14,16H,1-2H3.
What are the key properties of N-[4-(1-hydroxyethyl)phenyl]-2-methylpyrazole-3-sulfonamide?
N-[4-(1-hydroxyethyl)phenyl]-2-methylpyrazole-3-sulfonamide has a molecular weight of 281.34 g/mol, XLogP of 1.27, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(1-hydroxyethyl)phenyl]-2-methylpyrazole-3-sulfonamide is sourced from PubChem (CID 104710143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).