N-(1-piperidin-1-ylpropan-2-yl)-1H-pyrazole-4-sulfonamide

C11H20N4O2S — CID 61275215

IUPACN-(1-piperidin-1-ylpropan-2-yl)-1H-pyrazole-4-sulfonamide
SMILESCC(CN1CCCCC1)NS(=O)(=O)c1cn[nH]c1
InChIInChI=1S/C11H20N4O2S/c1-10(9-15-5-3-2-4-6-15)14-18(16,17)11-7-12-13-8-11/h7-8,10,14H,2-6,9H2,1H3,(H,12,13)
InChIKeyVDWVITIEYPMPTJ-UHFFFAOYSA-N
MW272.37 g/mol
LogP0.56
Rot. Bonds5

About N-(1-piperidin-1-ylpropan-2-yl)-1H-pyrazole-4-sulfonamide

N-(1-piperidin-1-ylpropan-2-yl)-1H-pyrazole-4-sulfonamide (PubChem CID 61275215) has the molecular formula C11H20N4O2S and a molecular weight of 272.37 g/mol. Its IUPAC name is N-(1-piperidin-1-ylpropan-2-yl)-1H-pyrazole-4-sulfonamide.

Molecular Properties

Compound NameN-(1-piperidin-1-ylpropan-2-yl)-1H-pyrazole-4-sulfonamide
PubChem CID61275215
Molecular FormulaC11H20N4O2S
Molecular Weight272.37 g/mol
Exact Mass272.13
IUPAC NameN-(1-piperidin-1-ylpropan-2-yl)-1H-pyrazole-4-sulfonamide
SMILESCC(CN1CCCCC1)NS(=O)(=O)c1cn[nH]c1
InChIInChI=1S/C11H20N4O2S/c1-10(9-15-5-3-2-4-6-15)14-18(16,17)11-7-12-13-8-11/h7-8,10,14H,2-6,9H2,1H3,(H,12,13)
InChIKeyVDWVITIEYPMPTJ-UHFFFAOYSA-N
XLogP0.56
TPSA78.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.37
LogP ≤ 50.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1-piperidin-1-ylpropan-2-yl)-1H-pyrazole-4-sulfonamide?
The IUPAC name of N-(1-piperidin-1-ylpropan-2-yl)-1H-pyrazole-4-sulfonamide (CID 61275215) is N-(1-piperidin-1-ylpropan-2-yl)-1H-pyrazole-4-sulfonamide.
What is the SMILES notation for N-(1-piperidin-1-ylpropan-2-yl)-1H-pyrazole-4-sulfonamide?
The canonical SMILES for N-(1-piperidin-1-ylpropan-2-yl)-1H-pyrazole-4-sulfonamide is CC(CN1CCCCC1)NS(=O)(=O)c1cn[nH]c1.
What is the InChIKey of N-(1-piperidin-1-ylpropan-2-yl)-1H-pyrazole-4-sulfonamide?
The InChIKey is VDWVITIEYPMPTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O2S/c1-10(9-15-5-3-2-4-6-15)14-18(16,17)11-7-12-13-8-11/h7-8,10,14H,2-6,9H2,1H3,(H,12,13).
What are the key properties of N-(1-piperidin-1-ylpropan-2-yl)-1H-pyrazole-4-sulfonamide?
N-(1-piperidin-1-ylpropan-2-yl)-1H-pyrazole-4-sulfonamide has a molecular weight of 272.37 g/mol, XLogP of 0.56, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-piperidin-1-ylpropan-2-yl)-1H-pyrazole-4-sulfonamide is sourced from PubChem (CID 61275215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).