1-(2-hydroxypropyl)pyrazole-4-sulfonamide

C6H11N3O3S — CID 130536517

IUPAC1-(2-hydroxypropyl)pyrazole-4-sulfonamide
SMILESCC(O)Cn1cc(S(N)(=O)=O)cn1
InChIInChI=1S/C6H11N3O3S/c1-5(10)3-9-4-6(2-8-9)13(7,11)12/h2,4-5,10H,3H2,1H3,(H2,7,11,12)
InChIKeyGNAIGTGGFNBWCD-UHFFFAOYSA-N
MW205.24 g/mol
LogP-1.09
Rot. Bonds3

About 1-(2-hydroxypropyl)pyrazole-4-sulfonamide

1-(2-hydroxypropyl)pyrazole-4-sulfonamide (PubChem CID 130536517) has the molecular formula C6H11N3O3S and a molecular weight of 205.24 g/mol. Its IUPAC name is 1-(2-hydroxypropyl)pyrazole-4-sulfonamide.

Molecular Properties

Compound Name1-(2-hydroxypropyl)pyrazole-4-sulfonamide
PubChem CID130536517
Molecular FormulaC6H11N3O3S
Molecular Weight205.24 g/mol
Exact Mass205.05
IUPAC Name1-(2-hydroxypropyl)pyrazole-4-sulfonamide
SMILESCC(O)Cn1cc(S(N)(=O)=O)cn1
InChIInChI=1S/C6H11N3O3S/c1-5(10)3-9-4-6(2-8-9)13(7,11)12/h2,4-5,10H,3H2,1H3,(H2,7,11,12)
InChIKeyGNAIGTGGFNBWCD-UHFFFAOYSA-N
XLogP-1.09
TPSA98.21 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.24
LogP ≤ 5-1.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(2R)-1-(4-methylsulfonylpyrazol-1-yl)propan-2-ol
CID 165472464
(2R)-1-(4-methylsulfonylpyrazol-1-yl)propan-2-amine
CID 165473094
(2R)-1-(4-bromopyrazol-1-yl)propan-2-ol
CID 93455524
1-pentan-2-ylpyrazole-4-sulfonamide
CID 107889714
1-decylpyrazole-4-sulfonamide
CID 81340467
1-[(2R)-2-hydroxypropyl]-N,N-bis[(4-methoxyphenyl)methyl]pyrazole-4-sulfonamide
CID 146797793
1-[2-oxo-2-(2-propan-2-ylazetidin-1-yl)ethyl]pyrazole-4-sulfonamide
CID 146126031
5-(4-methylsulfonylpyrazol-1-yl)pentan-2-ol
CID 165472463
4-fluoro-1-[(2R)-2-hydroxypropyl]pyrazole-3-sulfonamide
CID 146570976
2-amino-3-(4-methylsulfonylpyrazol-1-yl)propanoic acid
CID 165480243
N-[(1S)-1-(4-propan-2-ylphenyl)ethyl]-3-(4-sulfamoylpyrazol-1-yl)propanamide
CID 52525075
3,3-dimethyl-1-(4-methylsulfonylpyrazol-1-yl)butan-2-amine
CID 165471755

Frequently Asked Questions

What is the IUPAC name of 1-(2-hydroxypropyl)pyrazole-4-sulfonamide?
The IUPAC name of 1-(2-hydroxypropyl)pyrazole-4-sulfonamide (CID 130536517) is 1-(2-hydroxypropyl)pyrazole-4-sulfonamide.
What is the SMILES notation for 1-(2-hydroxypropyl)pyrazole-4-sulfonamide?
The canonical SMILES for 1-(2-hydroxypropyl)pyrazole-4-sulfonamide is CC(O)Cn1cc(S(N)(=O)=O)cn1.
What is the InChIKey of 1-(2-hydroxypropyl)pyrazole-4-sulfonamide?
The InChIKey is GNAIGTGGFNBWCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3O3S/c1-5(10)3-9-4-6(2-8-9)13(7,11)12/h2,4-5,10H,3H2,1H3,(H2,7,11,12).
What are the key properties of 1-(2-hydroxypropyl)pyrazole-4-sulfonamide?
1-(2-hydroxypropyl)pyrazole-4-sulfonamide has a molecular weight of 205.24 g/mol, XLogP of -1.09, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-hydroxypropyl)pyrazole-4-sulfonamide is sourced from PubChem (CID 130536517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).