N-[2-(furan-2-yl)ethyl]-1H-pyrazole-4-sulfonamide

C9H11N3O3S — CID 61026875

IUPACN-[2-(furan-2-yl)ethyl]-1H-pyrazole-4-sulfonamide
SMILESO=S(=O)(NCCc1ccco1)c1cn[nH]c1
InChIInChI=1S/C9H11N3O3S/c13-16(14,9-6-10-11-7-9)12-4-3-8-2-1-5-15-8/h1-2,5-7,12H,3-4H2,(H,10,11)
InChIKeyDBIVDUFIGFINPU-UHFFFAOYSA-N
MW241.27 g/mol
LogP0.52
Rot. Bonds5

About N-[2-(furan-2-yl)ethyl]-1H-pyrazole-4-sulfonamide

N-[2-(furan-2-yl)ethyl]-1H-pyrazole-4-sulfonamide (PubChem CID 61026875) has the molecular formula C9H11N3O3S and a molecular weight of 241.27 g/mol. Its IUPAC name is N-[2-(furan-2-yl)ethyl]-1H-pyrazole-4-sulfonamide.

Molecular Properties

Compound NameN-[2-(furan-2-yl)ethyl]-1H-pyrazole-4-sulfonamide
PubChem CID61026875
Molecular FormulaC9H11N3O3S
Molecular Weight241.27 g/mol
Exact Mass241.05
IUPAC NameN-[2-(furan-2-yl)ethyl]-1H-pyrazole-4-sulfonamide
SMILESO=S(=O)(NCCc1ccco1)c1cn[nH]c1
InChIInChI=1S/C9H11N3O3S/c13-16(14,9-6-10-11-7-9)12-4-3-8-2-1-5-15-8/h1-2,5-7,12H,3-4H2,(H,10,11)
InChIKeyDBIVDUFIGFINPU-UHFFFAOYSA-N
XLogP0.52
TPSA87.99 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.27
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(2-aminophenoxy)ethyl]-1H-pyrazole-4-sulfonamide
CID 54915290
N-[2-(4-hydroxyphenyl)ethyl]-1H-pyrazole-4-sulfonamide
CID 54903977
N-[2-(1H-imidazol-5-yl)ethyl]-1H-pyrazole-4-sulfonamide
CID 65231374
4-[2-(1H-pyrazol-4-ylsulfonylamino)ethyl]benzoic acid
CID 60917023
4-amino-N-[2-(furan-2-yl)ethyl]-3-methoxybenzenesulfonamide
CID 81438347
N-[2-(1,3-thiazol-2-yl)ethyl]-1H-pyrazole-4-sulfonamide
CID 49460068
N-cyclopentyl-N-(furan-2-ylmethyl)-1H-pyrazole-4-sulfonamide
CID 47268204
N-(3-methylsulfonylpropyl)-1H-pyrazole-4-sulfonamide
CID 47292229
N-[2-(furan-2-yl)ethyl]-4-[(3R)-5-oxopyrrolidin-3-yl]benzenesulfonamide
CID 7347386
N-[2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)ethyl]-1H-pyrazole-4-sulfonamide
CID 131929095
N-[2-(oxan-4-yl)ethyl]-1H-pyrazole-4-sulfonamide
CID 171675219
N-[[3-(chloromethyl)phenyl]methyl]-1H-pyrazole-4-sulfonamide
CID 65032352

Frequently Asked Questions

What is the IUPAC name of N-[2-(furan-2-yl)ethyl]-1H-pyrazole-4-sulfonamide?
The IUPAC name of N-[2-(furan-2-yl)ethyl]-1H-pyrazole-4-sulfonamide (CID 61026875) is N-[2-(furan-2-yl)ethyl]-1H-pyrazole-4-sulfonamide.
What is the SMILES notation for N-[2-(furan-2-yl)ethyl]-1H-pyrazole-4-sulfonamide?
The canonical SMILES for N-[2-(furan-2-yl)ethyl]-1H-pyrazole-4-sulfonamide is O=S(=O)(NCCc1ccco1)c1cn[nH]c1.
What is the InChIKey of N-[2-(furan-2-yl)ethyl]-1H-pyrazole-4-sulfonamide?
The InChIKey is DBIVDUFIGFINPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O3S/c13-16(14,9-6-10-11-7-9)12-4-3-8-2-1-5-15-8/h1-2,5-7,12H,3-4H2,(H,10,11).
What are the key properties of N-[2-(furan-2-yl)ethyl]-1H-pyrazole-4-sulfonamide?
N-[2-(furan-2-yl)ethyl]-1H-pyrazole-4-sulfonamide has a molecular weight of 241.27 g/mol, XLogP of 0.52, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(furan-2-yl)ethyl]-1H-pyrazole-4-sulfonamide is sourced from PubChem (CID 61026875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).