5-(3-fluorooxetan-3-yl)-1-methylpyrazole-3-sulfonamide

C7H10FN3O3S — CID 142588038

IUPAC5-(3-fluorooxetan-3-yl)-1-methylpyrazole-3-sulfonamide
SMILESCn1nc(S(N)(=O)=O)cc1C1(F)COC1
InChIInChI=1S/C7H10FN3O3S/c1-11-5(7(8)3-14-4-7)2-6(10-11)15(9,12)13/h2H,3-4H2,1H3,(H2,9,12,13)
InChIKeyQOGJCLLKYHXTTE-UHFFFAOYSA-N
MW235.24 g/mol
LogP-0.74
Rot. Bonds2

About 5-(3-fluorooxetan-3-yl)-1-methylpyrazole-3-sulfonamide

5-(3-fluorooxetan-3-yl)-1-methylpyrazole-3-sulfonamide (PubChem CID 142588038) has the molecular formula C7H10FN3O3S and a molecular weight of 235.24 g/mol. Its IUPAC name is 5-(3-fluorooxetan-3-yl)-1-methylpyrazole-3-sulfonamide.

Molecular Properties

Compound Name5-(3-fluorooxetan-3-yl)-1-methylpyrazole-3-sulfonamide
PubChem CID142588038
Molecular FormulaC7H10FN3O3S
Molecular Weight235.24 g/mol
Exact Mass235.04
IUPAC Name5-(3-fluorooxetan-3-yl)-1-methylpyrazole-3-sulfonamide
SMILESCn1nc(S(N)(=O)=O)cc1C1(F)COC1
InChIInChI=1S/C7H10FN3O3S/c1-11-5(7(8)3-14-4-7)2-6(10-11)15(9,12)13/h2H,3-4H2,1H3,(H2,9,12,13)
InChIKeyQOGJCLLKYHXTTE-UHFFFAOYSA-N
XLogP-0.74
TPSA87.21 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.24
LogP ≤ 5-0.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-Methyl-5-propan-2-ylpyrazole-3-sulfonamide
CID 122480585
5-(3-Methoxy-3-oxetanyl)-1-methyl-1H-pyrazole-3-sulfonamide
CID 137509735
5-[3-(Dimethylamino)oxetan-3-yl]-1-methylpyrazole-3-sulfonamide
CID 137512692
5-(3-Hydroxyoxetan-3-yl)-1-methylpyrazole-3-sulfonamide
CID 142587888
5-(2-Hydroxy-2-methylpropyl)-1-methylpyrazole-3-sulfonamide
CID 142587902
5-(3-Ethoxyoxetan-3-yl)-1-methylpyrazole-3-sulfonamide
CID 142587945
5-(2-Hydroxy-2-methylpropyl)-1-methylpyrazole-3-sulfinamide
CID 142587982
5-(3-Ethyloxetan-3-yl)-1-propan-2-ylpyrazole-3-sulfonamide
CID 156082475
1-Cyclopropyl-5-(3-ethyloxetan-3-yl)pyrazole-3-sulfonamide
CID 156082771
5-[3-(dimethylamino)oxetan-3-yl]-1-methyl-N-methylphosphanyl-N-(phosphanylmethyl)pyrazole-3-sulfonamide
CID 156339332
1-Ethyl-5-[2-(2-hydroxyethoxy)ethyl]pyrazole-3-sulfonamide
CID 164116167
1-methyl-3-(propan-2-yl)-1H-pyrazole-5-sulfonamide
CID 62408155

Frequently Asked Questions

What is the IUPAC name of 5-(3-fluorooxetan-3-yl)-1-methylpyrazole-3-sulfonamide?
The IUPAC name of 5-(3-fluorooxetan-3-yl)-1-methylpyrazole-3-sulfonamide (CID 142588038) is 5-(3-fluorooxetan-3-yl)-1-methylpyrazole-3-sulfonamide.
What is the SMILES notation for 5-(3-fluorooxetan-3-yl)-1-methylpyrazole-3-sulfonamide?
The canonical SMILES for 5-(3-fluorooxetan-3-yl)-1-methylpyrazole-3-sulfonamide is Cn1nc(S(N)(=O)=O)cc1C1(F)COC1.
What is the InChIKey of 5-(3-fluorooxetan-3-yl)-1-methylpyrazole-3-sulfonamide?
The InChIKey is QOGJCLLKYHXTTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10FN3O3S/c1-11-5(7(8)3-14-4-7)2-6(10-11)15(9,12)13/h2H,3-4H2,1H3,(H2,9,12,13).
What are the key properties of 5-(3-fluorooxetan-3-yl)-1-methylpyrazole-3-sulfonamide?
5-(3-fluorooxetan-3-yl)-1-methylpyrazole-3-sulfonamide has a molecular weight of 235.24 g/mol, XLogP of -0.74, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-fluorooxetan-3-yl)-1-methylpyrazole-3-sulfonamide is sourced from PubChem (CID 142588038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).