2-(1H-pyrazol-5-ylsulfonylamino)acetic acid

C5H7N3O4S — CID 102690627

IUPAC2-(1H-pyrazol-5-ylsulfonylamino)acetic acid
SMILESO=C(O)CNS(=O)(=O)c1ccn[nH]1
InChIInChI=1S/C5H7N3O4S/c9-5(10)3-7-13(11,12)4-1-2-6-8-4/h1-2,7H,3H2,(H,6,8)(H,9,10)
InChIKeyWVMXAWHDXFOWQG-UHFFFAOYSA-N
MW205.19 g/mol
LogP-1.23
Rot. Bonds4

About 2-(1H-pyrazol-5-ylsulfonylamino)acetic acid

2-(1H-pyrazol-5-ylsulfonylamino)acetic acid (PubChem CID 102690627) has the molecular formula C5H7N3O4S and a molecular weight of 205.19 g/mol. Its IUPAC name is 2-(1H-pyrazol-5-ylsulfonylamino)acetic acid.

Molecular Properties

Compound Name2-(1H-pyrazol-5-ylsulfonylamino)acetic acid
PubChem CID102690627
Molecular FormulaC5H7N3O4S
Molecular Weight205.19 g/mol
Exact Mass205.02
IUPAC Name2-(1H-pyrazol-5-ylsulfonylamino)acetic acid
SMILESO=C(O)CNS(=O)(=O)c1ccn[nH]1
InChIInChI=1S/C5H7N3O4S/c9-5(10)3-7-13(11,12)4-1-2-6-8-4/h1-2,7H,3H2,(H,6,8)(H,9,10)
InChIKeyWVMXAWHDXFOWQG-UHFFFAOYSA-N
XLogP-1.23
TPSA112.15 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.19
LogP ≤ 5-1.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-methyl-2-oxobutyl)-1H-pyrazole-5-sulfonamide
CID 102691239
N-cyclopropyl-2-(1H-pyrazol-5-ylsulfonylamino)acetamide
CID 102691693
4-methyl-5-(1H-pyrazol-5-ylsulfonylamino)pentanoic acid
CID 102690942
N-[(2R)-2-hydroxypropyl]-1H-pyrazole-5-sulfonamide
CID 102693499
2-[1-[(1H-pyrazol-5-ylsulfonylamino)methyl]cyclohexyl]acetic acid
CID 102690759
N-prop-2-enyl-1H-pyrazole-5-sulfonamide
CID 102690992
3-(1H-pyrazol-5-ylsulfonylamino)propanethioamide
CID 102691194
2-(1H-pyrazol-5-ylamino)acetic acid
CID 19590120
3-phenyl-3-(1H-pyrazol-5-ylsulfonylamino)propanoic acid
CID 102690630
N-(2-hydroxy-2-methyl-3-methylsulfanylpropyl)-1H-pyrazole-5-sulfonamide
CID 106245543
N-[(3-hydroxycyclobutyl)methyl]-1H-pyrazole-5-sulfonamide
CID 102693146
N-(3-ethyl-2-hydroxypentyl)-1H-pyrazole-5-sulfonamide
CID 114168833

Frequently Asked Questions

What is the IUPAC name of 2-(1H-pyrazol-5-ylsulfonylamino)acetic acid?
The IUPAC name of 2-(1H-pyrazol-5-ylsulfonylamino)acetic acid (CID 102690627) is 2-(1H-pyrazol-5-ylsulfonylamino)acetic acid.
What is the SMILES notation for 2-(1H-pyrazol-5-ylsulfonylamino)acetic acid?
The canonical SMILES for 2-(1H-pyrazol-5-ylsulfonylamino)acetic acid is O=C(O)CNS(=O)(=O)c1ccn[nH]1.
What is the InChIKey of 2-(1H-pyrazol-5-ylsulfonylamino)acetic acid?
The InChIKey is WVMXAWHDXFOWQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7N3O4S/c9-5(10)3-7-13(11,12)4-1-2-6-8-4/h1-2,7H,3H2,(H,6,8)(H,9,10).
What are the key properties of 2-(1H-pyrazol-5-ylsulfonylamino)acetic acid?
2-(1H-pyrazol-5-ylsulfonylamino)acetic acid has a molecular weight of 205.19 g/mol, XLogP of -1.23, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-pyrazol-5-ylsulfonylamino)acetic acid is sourced from PubChem (CID 102690627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).