N-(1H-indazol-6-yl)propane-1-sulfonamide

C10H13N3O2S — CID 2444852

IUPACN-(1H-indazol-6-yl)propane-1-sulfonamide
SMILESCCCS(=O)(=O)Nc1ccc2cn[nH]c2c1
InChIInChI=1S/C10H13N3O2S/c1-2-5-16(14,15)13-9-4-3-8-7-11-12-10(8)6-9/h3-4,6-7,13H,2,5H2,1H3,(H,11,12)
InChIKeyUQJGGJHWVMGZFS-UHFFFAOYSA-N
MW239.30 g/mol
LogP1.71
Rot. Bonds4

About N-(1H-indazol-6-yl)propane-1-sulfonamide

N-(1H-indazol-6-yl)propane-1-sulfonamide (PubChem CID 2444852) has the molecular formula C10H13N3O2S and a molecular weight of 239.30 g/mol. Its IUPAC name is N-(1H-indazol-6-yl)propane-1-sulfonamide.

Molecular Properties

Compound NameN-(1H-indazol-6-yl)propane-1-sulfonamide
PubChem CID2444852
Molecular FormulaC10H13N3O2S
Molecular Weight239.30 g/mol
Exact Mass239.07
IUPAC NameN-(1H-indazol-6-yl)propane-1-sulfonamide
SMILESCCCS(=O)(=O)Nc1ccc2cn[nH]c2c1
InChIInChI=1S/C10H13N3O2S/c1-2-5-16(14,15)13-9-4-3-8-7-11-12-10(8)6-9/h3-4,6-7,13H,2,5H2,1H3,(H,11,12)
InChIKeyUQJGGJHWVMGZFS-UHFFFAOYSA-N
XLogP1.71
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.30
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1H-indazol-6-yl)propane-1-sulfonamide?
The IUPAC name of N-(1H-indazol-6-yl)propane-1-sulfonamide (CID 2444852) is N-(1H-indazol-6-yl)propane-1-sulfonamide.
What is the SMILES notation for N-(1H-indazol-6-yl)propane-1-sulfonamide?
The canonical SMILES for N-(1H-indazol-6-yl)propane-1-sulfonamide is CCCS(=O)(=O)Nc1ccc2cn[nH]c2c1.
What is the InChIKey of N-(1H-indazol-6-yl)propane-1-sulfonamide?
The InChIKey is UQJGGJHWVMGZFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O2S/c1-2-5-16(14,15)13-9-4-3-8-7-11-12-10(8)6-9/h3-4,6-7,13H,2,5H2,1H3,(H,11,12).
What are the key properties of N-(1H-indazol-6-yl)propane-1-sulfonamide?
N-(1H-indazol-6-yl)propane-1-sulfonamide has a molecular weight of 239.30 g/mol, XLogP of 1.71, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indazol-6-yl)propane-1-sulfonamide is sourced from PubChem (CID 2444852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).