N-(5-amino-2-pyridinyl)-1H-pyrazole-5-sulfonamide

C8H9N5O2S — CID 102690503

IUPACN-(5-amino-2-pyridinyl)-1H-pyrazole-5-sulfonamide
SMILESNc1ccc(NS(=O)(=O)c2ccn[nH]2)nc1
InChIInChI=1S/C8H9N5O2S/c9-6-1-2-7(10-5-6)13-16(14,15)8-3-4-11-12-8/h1-5H,9H2,(H,10,13)(H,11,12)
InChIKeyFTISTMBDQOZSQS-UHFFFAOYSA-N
MW239.26 g/mol
LogP0.19
Rot. Bonds3

About N-(5-amino-2-pyridinyl)-1H-pyrazole-5-sulfonamide

N-(5-amino-2-pyridinyl)-1H-pyrazole-5-sulfonamide (PubChem CID 102690503) has the molecular formula C8H9N5O2S and a molecular weight of 239.26 g/mol. Its IUPAC name is N-(5-amino-2-pyridinyl)-1H-pyrazole-5-sulfonamide.

Molecular Properties

Compound NameN-(5-amino-2-pyridinyl)-1H-pyrazole-5-sulfonamide
PubChem CID102690503
Molecular FormulaC8H9N5O2S
Molecular Weight239.26 g/mol
Exact Mass239.05
IUPAC NameN-(5-amino-2-pyridinyl)-1H-pyrazole-5-sulfonamide
SMILESNc1ccc(NS(=O)(=O)c2ccn[nH]2)nc1
InChIInChI=1S/C8H9N5O2S/c9-6-1-2-7(10-5-6)13-16(14,15)8-3-4-11-12-8/h1-5H,9H2,(H,10,13)(H,11,12)
InChIKeyFTISTMBDQOZSQS-UHFFFAOYSA-N
XLogP0.19
TPSA113.76 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.26
LogP ≤ 50.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(5-amino-2-pyridinyl)-1H-pyrazole-5-sulfonamide?
The IUPAC name of N-(5-amino-2-pyridinyl)-1H-pyrazole-5-sulfonamide (CID 102690503) is N-(5-amino-2-pyridinyl)-1H-pyrazole-5-sulfonamide.
What is the SMILES notation for N-(5-amino-2-pyridinyl)-1H-pyrazole-5-sulfonamide?
The canonical SMILES for N-(5-amino-2-pyridinyl)-1H-pyrazole-5-sulfonamide is Nc1ccc(NS(=O)(=O)c2ccn[nH]2)nc1.
What is the InChIKey of N-(5-amino-2-pyridinyl)-1H-pyrazole-5-sulfonamide?
The InChIKey is FTISTMBDQOZSQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N5O2S/c9-6-1-2-7(10-5-6)13-16(14,15)8-3-4-11-12-8/h1-5H,9H2,(H,10,13)(H,11,12).
What are the key properties of N-(5-amino-2-pyridinyl)-1H-pyrazole-5-sulfonamide?
N-(5-amino-2-pyridinyl)-1H-pyrazole-5-sulfonamide has a molecular weight of 239.26 g/mol, XLogP of 0.19, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-2-pyridinyl)-1H-pyrazole-5-sulfonamide is sourced from PubChem (CID 102690503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).