1-(4-methoxyphenyl)sulfonylpyrazole

C10H10N2O3S — CID 844644

IUPAC1-(4-methoxyphenyl)sulfonylpyrazole
SMILESCOc1ccc(S(=O)(=O)n2cccn2)cc1
InChIInChI=1S/C10H10N2O3S/c1-15-9-3-5-10(6-4-9)16(13,14)12-8-2-7-11-12/h2-8H,1H3
InChIKeyVUHHYUFMCKQPEN-UHFFFAOYSA-N
MW238.27 g/mol
LogP1.13
Rot. Bonds3

About 1-(4-methoxyphenyl)sulfonylpyrazole

1-(4-methoxyphenyl)sulfonylpyrazole (PubChem CID 844644) has the molecular formula C10H10N2O3S and a molecular weight of 238.27 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)sulfonylpyrazole.

Molecular Properties

Compound Name1-(4-methoxyphenyl)sulfonylpyrazole
PubChem CID844644
Molecular FormulaC10H10N2O3S
Molecular Weight238.27 g/mol
Exact Mass238.04
IUPAC Name1-(4-methoxyphenyl)sulfonylpyrazole
SMILESCOc1ccc(S(=O)(=O)n2cccn2)cc1
InChIInChI=1S/C10H10N2O3S/c1-15-9-3-5-10(6-4-9)16(13,14)12-8-2-7-11-12/h2-8H,1H3
InChIKeyVUHHYUFMCKQPEN-UHFFFAOYSA-N
XLogP1.13
TPSA61.19 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.27
LogP ≤ 51.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-(2,5-Dimethoxyphenyl)sulfonyl-3-methylpyrazole
CID 1085562
1-(4-Methoxy-3-methyl-benzenesulfonyl)-3-methyl-1H-pyrazole
CID 1085563
1-(4-Ethoxyphenyl)sulfonyl-3,5-dimethylpyrazole
CID 847006
1-(2,5-Dimethoxyphenyl)sulfonylpyrazole
CID 646938
1-(4-Ethoxyphenyl)sulfonyl-3-methylpyrazole
CID 1085564
4-ethoxy-N-[(1-ethylpyrazol-4-yl)methyl]-N-methylbenzenesulfonamide
CID 4089498
1-(3-Ethoxy-4-fluorophenyl)sulfonyl-3-methylpyrazole
CID 2147934
1-(3-Ethoxy-4-fluorophenyl)sulfonylpyrazole
CID 6499731
N-(1-ethylpyrazol-4-yl)-4-methoxybenzenesulfonamide
CID 31912961
1-[(4-methoxyphenyl)sulfonyl]-3,5-dimethyl-1H-pyrazole
CID 871651
1-(3,4-Dimethoxyphenyl)sulfonylpyrazole
CID 778403
1-(4-Ethoxyphenyl)sulfonylpyrazole
CID 6463761

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)sulfonylpyrazole?
The IUPAC name of 1-(4-methoxyphenyl)sulfonylpyrazole (CID 844644) is 1-(4-methoxyphenyl)sulfonylpyrazole.
What is the SMILES notation for 1-(4-methoxyphenyl)sulfonylpyrazole?
The canonical SMILES for 1-(4-methoxyphenyl)sulfonylpyrazole is COc1ccc(S(=O)(=O)n2cccn2)cc1.
What is the InChIKey of 1-(4-methoxyphenyl)sulfonylpyrazole?
The InChIKey is VUHHYUFMCKQPEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O3S/c1-15-9-3-5-10(6-4-9)16(13,14)12-8-2-7-11-12/h2-8H,1H3.
What are the key properties of 1-(4-methoxyphenyl)sulfonylpyrazole?
1-(4-methoxyphenyl)sulfonylpyrazole has a molecular weight of 238.27 g/mol, XLogP of 1.13, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)sulfonylpyrazole is sourced from PubChem (CID 844644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).