N-(5-propyl-1H-pyrazol-3-yl)propane-2-sulfonamide

C9H17N3O2S — CID 115698347

IUPACN-(5-propyl-1H-pyrazol-3-yl)propane-2-sulfonamide
SMILESCCCc1cc(NS(=O)(=O)C(C)C)n[nH]1
InChIInChI=1S/C9H17N3O2S/c1-4-5-8-6-9(11-10-8)12-15(13,14)7(2)3/h6-7H,4-5H2,1-3H3,(H2,10,11,12)
InChIKeySLSBNCCYNOPJEN-UHFFFAOYSA-N
MW231.32 g/mol
LogP1.51
Rot. Bonds5

About N-(5-propyl-1H-pyrazol-3-yl)propane-2-sulfonamide

N-(5-propyl-1H-pyrazol-3-yl)propane-2-sulfonamide (PubChem CID 115698347) has the molecular formula C9H17N3O2S and a molecular weight of 231.32 g/mol. Its IUPAC name is N-(5-propyl-1H-pyrazol-3-yl)propane-2-sulfonamide.

Molecular Properties

Compound NameN-(5-propyl-1H-pyrazol-3-yl)propane-2-sulfonamide
PubChem CID115698347
Molecular FormulaC9H17N3O2S
Molecular Weight231.32 g/mol
Exact Mass231.10
IUPAC NameN-(5-propyl-1H-pyrazol-3-yl)propane-2-sulfonamide
SMILESCCCc1cc(NS(=O)(=O)C(C)C)n[nH]1
InChIInChI=1S/C9H17N3O2S/c1-4-5-8-6-9(11-10-8)12-15(13,14)7(2)3/h6-7H,4-5H2,1-3H3,(H2,10,11,12)
InChIKeySLSBNCCYNOPJEN-UHFFFAOYSA-N
XLogP1.51
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.32
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(methylsulfamoyl)-5-propyl-1H-pyrazol-3-amine
CID 114810260
1-(4-fluorophenyl)-N-(5-propyl-1H-pyrazol-3-yl)methanesulfonamide
CID 115698303
1-(4-aminophenyl)-N-(5-propyl-1H-pyrazol-3-yl)methanesulfonamide
CID 104616865
3-methoxy-N-(5-propyl-1H-pyrazol-3-yl)propane-1-sulfonamide
CID 104620677
3-methyl-N-(5-propyl-1H-pyrazol-3-yl)butanamide
CID 115619770
2,4-dimethyl-N-(5-propyl-1H-pyrazol-3-yl)benzenesulfonamide
CID 115692563
6-amino-N-(5-propyl-1H-pyrazol-3-yl)pyridine-3-sulfonamide
CID 104616839
1-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyrazole-4-sulfonamide
CID 112699565
1-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyrrole-3-sulfonamide
CID 104620727
4-[(5-propyl-1H-pyrazol-3-yl)sulfamoyl]benzoic acid
CID 104617482
6-oxo-N-(5-propyl-1H-pyrazol-3-yl)-1H-pyridine-3-sulfonamide
CID 104619447
2-amino-4,6-dibromo-N-(5-propyl-1H-pyrazol-3-yl)benzenesulfonamide
CID 104616854

Frequently Asked Questions

What is the IUPAC name of N-(5-propyl-1H-pyrazol-3-yl)propane-2-sulfonamide?
The IUPAC name of N-(5-propyl-1H-pyrazol-3-yl)propane-2-sulfonamide (CID 115698347) is N-(5-propyl-1H-pyrazol-3-yl)propane-2-sulfonamide.
What is the SMILES notation for N-(5-propyl-1H-pyrazol-3-yl)propane-2-sulfonamide?
The canonical SMILES for N-(5-propyl-1H-pyrazol-3-yl)propane-2-sulfonamide is CCCc1cc(NS(=O)(=O)C(C)C)n[nH]1.
What is the InChIKey of N-(5-propyl-1H-pyrazol-3-yl)propane-2-sulfonamide?
The InChIKey is SLSBNCCYNOPJEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O2S/c1-4-5-8-6-9(11-10-8)12-15(13,14)7(2)3/h6-7H,4-5H2,1-3H3,(H2,10,11,12).
What are the key properties of N-(5-propyl-1H-pyrazol-3-yl)propane-2-sulfonamide?
N-(5-propyl-1H-pyrazol-3-yl)propane-2-sulfonamide has a molecular weight of 231.32 g/mol, XLogP of 1.51, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-propyl-1H-pyrazol-3-yl)propane-2-sulfonamide is sourced from PubChem (CID 115698347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).