5-amino-N-(3-methyl-1,2-oxazol-5-yl)-1H-pyrazole-4-sulfonamide

C7H9N5O3S — CID 60808429

IUPAC5-amino-N-(3-methyl-1,2-oxazol-5-yl)-1H-pyrazole-4-sulfonamide
SMILESCc1cc(NS(=O)(=O)c2cn[nH]c2N)on1
InChIInChI=1S/C7H9N5O3S/c1-4-2-6(15-11-4)12-16(13,14)5-3-9-10-7(5)8/h2-3,12H,1H3,(H3,8,9,10)
InChIKeyALVGYPDLTRJTNX-UHFFFAOYSA-N
MW243.25 g/mol
LogP0.09
Rot. Bonds3

About 5-amino-N-(3-methyl-1,2-oxazol-5-yl)-1H-pyrazole-4-sulfonamide

5-amino-N-(3-methyl-1,2-oxazol-5-yl)-1H-pyrazole-4-sulfonamide (PubChem CID 60808429) has the molecular formula C7H9N5O3S and a molecular weight of 243.25 g/mol. Its IUPAC name is 5-amino-N-(3-methyl-1,2-oxazol-5-yl)-1H-pyrazole-4-sulfonamide.

Molecular Properties

Compound Name5-amino-N-(3-methyl-1,2-oxazol-5-yl)-1H-pyrazole-4-sulfonamide
PubChem CID60808429
Molecular FormulaC7H9N5O3S
Molecular Weight243.25 g/mol
Exact Mass243.04
IUPAC Name5-amino-N-(3-methyl-1,2-oxazol-5-yl)-1H-pyrazole-4-sulfonamide
SMILESCc1cc(NS(=O)(=O)c2cn[nH]c2N)on1
InChIInChI=1S/C7H9N5O3S/c1-4-2-6(15-11-4)12-16(13,14)5-3-9-10-7(5)8/h2-3,12H,1H3,(H3,8,9,10)
InChIKeyALVGYPDLTRJTNX-UHFFFAOYSA-N
XLogP0.09
TPSA126.90 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.25
LogP ≤ 50.09
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-amino-N-(3-methyl-1,2-oxazol-5-yl)-1H-pyrazole-4-sulfonamide?
The IUPAC name of 5-amino-N-(3-methyl-1,2-oxazol-5-yl)-1H-pyrazole-4-sulfonamide (CID 60808429) is 5-amino-N-(3-methyl-1,2-oxazol-5-yl)-1H-pyrazole-4-sulfonamide.
What is the SMILES notation for 5-amino-N-(3-methyl-1,2-oxazol-5-yl)-1H-pyrazole-4-sulfonamide?
The canonical SMILES for 5-amino-N-(3-methyl-1,2-oxazol-5-yl)-1H-pyrazole-4-sulfonamide is Cc1cc(NS(=O)(=O)c2cn[nH]c2N)on1.
What is the InChIKey of 5-amino-N-(3-methyl-1,2-oxazol-5-yl)-1H-pyrazole-4-sulfonamide?
The InChIKey is ALVGYPDLTRJTNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N5O3S/c1-4-2-6(15-11-4)12-16(13,14)5-3-9-10-7(5)8/h2-3,12H,1H3,(H3,8,9,10).
What are the key properties of 5-amino-N-(3-methyl-1,2-oxazol-5-yl)-1H-pyrazole-4-sulfonamide?
5-amino-N-(3-methyl-1,2-oxazol-5-yl)-1H-pyrazole-4-sulfonamide has a molecular weight of 243.25 g/mol, XLogP of 0.09, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-(3-methyl-1,2-oxazol-5-yl)-1H-pyrazole-4-sulfonamide is sourced from PubChem (CID 60808429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).