1-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyrrole-3-sulfonamide

C11H16N4O2S — CID 104620727

IUPAC1-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyrrole-3-sulfonamide
SMILESCCCc1cc(NS(=O)(=O)c2ccn(C)c2)n[nH]1
InChIInChI=1S/C11H16N4O2S/c1-3-4-9-7-11(13-12-9)14-18(16,17)10-5-6-15(2)8-10/h5-8H,3-4H2,1-2H3,(H2,12,13,14)
InChIKeyOGGHHVJGZXBTTC-UHFFFAOYSA-N
MW268.34 g/mol
LogP1.50
Rot. Bonds5

About 1-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyrrole-3-sulfonamide

1-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyrrole-3-sulfonamide (PubChem CID 104620727) has the molecular formula C11H16N4O2S and a molecular weight of 268.34 g/mol. Its IUPAC name is 1-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyrrole-3-sulfonamide.

Molecular Properties

Compound Name1-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyrrole-3-sulfonamide
PubChem CID104620727
Molecular FormulaC11H16N4O2S
Molecular Weight268.34 g/mol
Exact Mass268.10
IUPAC Name1-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyrrole-3-sulfonamide
SMILESCCCc1cc(NS(=O)(=O)c2ccn(C)c2)n[nH]1
InChIInChI=1S/C11H16N4O2S/c1-3-4-9-7-11(13-12-9)14-18(16,17)10-5-6-15(2)8-10/h5-8H,3-4H2,1-2H3,(H2,12,13,14)
InChIKeyOGGHHVJGZXBTTC-UHFFFAOYSA-N
XLogP1.50
TPSA79.78 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.34
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-methyl-N-(5-methyl-1H-pyrazol-3-yl)pyrrole-3-sulfonamide
CID 63822247
1-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyrazole-4-sulfonamide
CID 112699565
3-amino-4-hydroxy-N-(5-propyl-1H-pyrazol-3-yl)benzenesulfonamide
CID 104616817
6-amino-N-(5-propyl-1H-pyrazol-3-yl)pyridine-3-sulfonamide
CID 104616839
6-oxo-N-(5-propyl-1H-pyrazol-3-yl)-1H-pyridine-3-sulfonamide
CID 104619447
4-[(5-propyl-1H-pyrazol-3-yl)sulfamoyl]benzoic acid
CID 104617482
4-[(5-propyl-1H-pyrazol-3-yl)sulfamoyl]benzamide
CID 115698308
N-(5-ethyl-1H-pyrazol-3-yl)-4-propylbenzenesulfonamide
CID 115701449
N-(methylsulfamoyl)-5-propyl-1H-pyrazol-3-amine
CID 114810260
2,4-dimethyl-N-(5-propyl-1H-pyrazol-3-yl)benzenesulfonamide
CID 115692563
5-chloro-6-oxo-N-(5-propyl-1H-pyrazol-3-yl)-1H-pyridine-3-sulfonamide
CID 104619451
N-(5-butyl-1H-pyrazol-3-yl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
CID 126789295

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyrrole-3-sulfonamide?
The IUPAC name of 1-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyrrole-3-sulfonamide (CID 104620727) is 1-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyrrole-3-sulfonamide.
What is the SMILES notation for 1-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyrrole-3-sulfonamide?
The canonical SMILES for 1-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyrrole-3-sulfonamide is CCCc1cc(NS(=O)(=O)c2ccn(C)c2)n[nH]1.
What is the InChIKey of 1-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyrrole-3-sulfonamide?
The InChIKey is OGGHHVJGZXBTTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O2S/c1-3-4-9-7-11(13-12-9)14-18(16,17)10-5-6-15(2)8-10/h5-8H,3-4H2,1-2H3,(H2,12,13,14).
What are the key properties of 1-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyrrole-3-sulfonamide?
1-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyrrole-3-sulfonamide has a molecular weight of 268.34 g/mol, XLogP of 1.50, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(5-propyl-1H-pyrazol-3-yl)pyrrole-3-sulfonamide is sourced from PubChem (CID 104620727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).