N-(4-chloro-2-pyridinyl)-1-methylpyrazole-4-sulfonamide

C9H9ClN4O2S — CID 71972209

IUPACN-(4-chloro-2-pyridinyl)-1-methylpyrazole-4-sulfonamide
SMILESCn1cc(S(=O)(=O)Nc2cc(Cl)ccn2)cn1
InChIInChI=1S/C9H9ClN4O2S/c1-14-6-8(5-12-14)17(15,16)13-9-4-7(10)2-3-11-9/h2-6H,1H3,(H,11,13)
InChIKeyJNLYNHGOVMYOMI-UHFFFAOYSA-N
MW272.72 g/mol
LogP1.27
Rot. Bonds3

About N-(4-chloro-2-pyridinyl)-1-methylpyrazole-4-sulfonamide

N-(4-chloro-2-pyridinyl)-1-methylpyrazole-4-sulfonamide (PubChem CID 71972209) has the molecular formula C9H9ClN4O2S and a molecular weight of 272.72 g/mol. Its IUPAC name is N-(4-chloro-2-pyridinyl)-1-methylpyrazole-4-sulfonamide.

Molecular Properties

Compound NameN-(4-chloro-2-pyridinyl)-1-methylpyrazole-4-sulfonamide
PubChem CID71972209
Molecular FormulaC9H9ClN4O2S
Molecular Weight272.72 g/mol
Exact Mass272.01
IUPAC NameN-(4-chloro-2-pyridinyl)-1-methylpyrazole-4-sulfonamide
SMILESCn1cc(S(=O)(=O)Nc2cc(Cl)ccn2)cn1
InChIInChI=1S/C9H9ClN4O2S/c1-14-6-8(5-12-14)17(15,16)13-9-4-7(10)2-3-11-9/h2-6H,1H3,(H,11,13)
InChIKeyJNLYNHGOVMYOMI-UHFFFAOYSA-N
XLogP1.27
TPSA76.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.72
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-chloro-N-(4-chloro-2-pyridinyl)pyrimidine-5-sulfonamide
CID 114052244
N-(5-chloro-2-methoxyphenyl)-1-methylpyrazole-4-sulfonamide
CID 47177541
N-(5-amino-2-pyridinyl)-1-methylpyrazole-4-sulfonamide
CID 62062956
N-(4-chloro-2-pyridinyl)-3-methylbenzenesulfonamide
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4-(chloromethyl)-N-(4-chloro-2-pyridinyl)benzenesulfonamide
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N-(4-chloro-2-pyridinyl)pyrrolidine-1-sulfonamide
CID 104821716
4-chloro-N-(methylsulfamoyl)pyridin-2-amine
CID 114813660
N-[5-(aminomethyl)-2-pyridinyl]-1-methylpyrazole-4-sulfonamide
CID 62353719
N-(5-tert-butyl-1H-pyrazol-3-yl)-1-methylpyrazole-4-sulfonamide
CID 112695660
N-(4-chloro-2-pyridinyl)sulfamoyl chloride
CID 84760693
N-(4-chloro-2-pyridinyl)azepane-1-sulfonamide
CID 104821771
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CID 81422727

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-2-pyridinyl)-1-methylpyrazole-4-sulfonamide?
The IUPAC name of N-(4-chloro-2-pyridinyl)-1-methylpyrazole-4-sulfonamide (CID 71972209) is N-(4-chloro-2-pyridinyl)-1-methylpyrazole-4-sulfonamide.
What is the SMILES notation for N-(4-chloro-2-pyridinyl)-1-methylpyrazole-4-sulfonamide?
The canonical SMILES for N-(4-chloro-2-pyridinyl)-1-methylpyrazole-4-sulfonamide is Cn1cc(S(=O)(=O)Nc2cc(Cl)ccn2)cn1.
What is the InChIKey of N-(4-chloro-2-pyridinyl)-1-methylpyrazole-4-sulfonamide?
The InChIKey is JNLYNHGOVMYOMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9ClN4O2S/c1-14-6-8(5-12-14)17(15,16)13-9-4-7(10)2-3-11-9/h2-6H,1H3,(H,11,13).
What are the key properties of N-(4-chloro-2-pyridinyl)-1-methylpyrazole-4-sulfonamide?
N-(4-chloro-2-pyridinyl)-1-methylpyrazole-4-sulfonamide has a molecular weight of 272.72 g/mol, XLogP of 1.27, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-2-pyridinyl)-1-methylpyrazole-4-sulfonamide is sourced from PubChem (CID 71972209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).