N-(1H-indazol-3-yl)methanesulfonamide

C8H9N3O2S — CID 62686939

IUPACN-(1H-indazol-3-yl)methanesulfonamide
SMILESCS(=O)(=O)Nc1n[nH]c2ccccc12
InChIInChI=1S/C8H9N3O2S/c1-14(12,13)11-8-6-4-2-3-5-7(6)9-10-8/h2-5H,1H3,(H2,9,10,11)
InChIKeyZZCFYWODMJHQHC-UHFFFAOYSA-N
MW211.25 g/mol
LogP0.93
Rot. Bonds2

About N-(1H-indazol-3-yl)methanesulfonamide

N-(1H-indazol-3-yl)methanesulfonamide (PubChem CID 62686939) has the molecular formula C8H9N3O2S and a molecular weight of 211.25 g/mol. Its IUPAC name is N-(1H-indazol-3-yl)methanesulfonamide.

Molecular Properties

Compound NameN-(1H-indazol-3-yl)methanesulfonamide
PubChem CID62686939
Molecular FormulaC8H9N3O2S
Molecular Weight211.25 g/mol
Exact Mass211.04
IUPAC NameN-(1H-indazol-3-yl)methanesulfonamide
SMILESCS(=O)(=O)Nc1n[nH]c2ccccc12
InChIInChI=1S/C8H9N3O2S/c1-14(12,13)11-8-6-4-2-3-5-7(6)9-10-8/h2-5H,1H3,(H2,9,10,11)
InChIKeyZZCFYWODMJHQHC-UHFFFAOYSA-N
XLogP0.93
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.25
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1H-indazol-3-amine
CID 13399
N-(1H-indazol-4-yl)methanesulfonamide
CID 1481965
4-(3-amino-1H-indazol-5-yl)-N-tert-butylbenzenesulfonamide
CID 24963047
3-methyl-1H-indazole
CID 820804
4-fluoro-N-(3-methyl-1H-indazol-5-yl)butane-1-sulfonamide
CID 137523337
5-phenyl-1H-indazol-3-amine
CID 11492186
4-fluoro-1H-indazol-3-amine
CID 817911
N-[4-(6-fluoro-1H-indazol-3-yl)phenyl]methanesulfonamide
CID 155424827
Bay-H-1127
CID 16736
N-[4-(3-amino-1H-indazol-6-yl)phenyl]-1-phenylmethanesulfonamide
CID 118721250
N-[5-(3,5-dicyano-2,6-dimethyl-3,4-dihydropyridin-4-yl)-1H-indazol-3-yl]propane-1-sulfonamide
CID 91808179
5-fluoro-1H-indazol-3-amine
CID 4327896

Frequently Asked Questions

What is the IUPAC name of N-(1H-indazol-3-yl)methanesulfonamide?
The IUPAC name of N-(1H-indazol-3-yl)methanesulfonamide (CID 62686939) is N-(1H-indazol-3-yl)methanesulfonamide.
What is the SMILES notation for N-(1H-indazol-3-yl)methanesulfonamide?
The canonical SMILES for N-(1H-indazol-3-yl)methanesulfonamide is CS(=O)(=O)Nc1n[nH]c2ccccc12.
What is the InChIKey of N-(1H-indazol-3-yl)methanesulfonamide?
The InChIKey is ZZCFYWODMJHQHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3O2S/c1-14(12,13)11-8-6-4-2-3-5-7(6)9-10-8/h2-5H,1H3,(H2,9,10,11).
What are the key properties of N-(1H-indazol-3-yl)methanesulfonamide?
N-(1H-indazol-3-yl)methanesulfonamide has a molecular weight of 211.25 g/mol, XLogP of 0.93, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indazol-3-yl)methanesulfonamide is sourced from PubChem (CID 62686939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).