N-[2-(furan-3-yl)ethyl]-1-methylpyrazole-4-sulfonamide

C10H13N3O3S — CID 71807049

IUPACN-[2-(furan-3-yl)ethyl]-1-methylpyrazole-4-sulfonamide
SMILESCn1cc(S(=O)(=O)NCCc2ccoc2)cn1
InChIInChI=1S/C10H13N3O3S/c1-13-7-10(6-11-13)17(14,15)12-4-2-9-3-5-16-8-9/h3,5-8,12H,2,4H2,1H3
InChIKeyPHERFDDAAMVOJX-UHFFFAOYSA-N
MW255.30 g/mol
LogP0.53
Rot. Bonds5

About N-[2-(furan-3-yl)ethyl]-1-methylpyrazole-4-sulfonamide

N-[2-(furan-3-yl)ethyl]-1-methylpyrazole-4-sulfonamide (PubChem CID 71807049) has the molecular formula C10H13N3O3S and a molecular weight of 255.30 g/mol. Its IUPAC name is N-[2-(furan-3-yl)ethyl]-1-methylpyrazole-4-sulfonamide.

Molecular Properties

Compound NameN-[2-(furan-3-yl)ethyl]-1-methylpyrazole-4-sulfonamide
PubChem CID71807049
Molecular FormulaC10H13N3O3S
Molecular Weight255.30 g/mol
Exact Mass255.07
IUPAC NameN-[2-(furan-3-yl)ethyl]-1-methylpyrazole-4-sulfonamide
SMILESCn1cc(S(=O)(=O)NCCc2ccoc2)cn1
InChIInChI=1S/C10H13N3O3S/c1-13-7-10(6-11-13)17(14,15)12-4-2-9-3-5-16-8-9/h3,5-8,12H,2,4H2,1H3
InChIKeyPHERFDDAAMVOJX-UHFFFAOYSA-N
XLogP0.53
TPSA77.13 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.30
LogP ≤ 50.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-chloroethyl)-1-methylpyrazole-4-sulfonamide
CID 62062630
N-[2-(1-methylpyrazol-4-yl)ethyl]benzenesulfonamide
CID 47235671
1-methyl-N-(2-sulfamoylethyl)pyrazole-4-sulfonamide
CID 62063368
2-[(1-methylpyrazol-4-yl)sulfonylamino]ethanesulfonyl chloride
CID 81358188
4-(methylamino)-N-[2-(1-methylpyrazol-4-yl)ethyl]benzenesulfonamide
CID 80689629
N-(6-chlorohexyl)-1-methylpyrazole-4-sulfonamide
CID 107849199
N-(3-chlorobutyl)-1-methylpyrazole-4-sulfonamide
CID 65032541
N-(5-iodopentyl)-1-methylpyrazole-4-sulfonamide
CID 107322883
4-(ethylamino)-N-[2-(1-methylpyrazol-4-yl)ethyl]benzenesulfonamide
CID 80685575
4-[(1-methylpyrazol-4-yl)sulfonylamino]butanoic acid
CID 43361171
N-[2-(1,3-benzothiazol-2-yl)ethyl]-1-methylpyrazole-4-sulfonamide
CID 71866461
3-amino-N-[2-(1-methylpyrazol-4-yl)ethyl]benzenesulfonamide
CID 80681451

Frequently Asked Questions

What is the IUPAC name of N-[2-(furan-3-yl)ethyl]-1-methylpyrazole-4-sulfonamide?
The IUPAC name of N-[2-(furan-3-yl)ethyl]-1-methylpyrazole-4-sulfonamide (CID 71807049) is N-[2-(furan-3-yl)ethyl]-1-methylpyrazole-4-sulfonamide.
What is the SMILES notation for N-[2-(furan-3-yl)ethyl]-1-methylpyrazole-4-sulfonamide?
The canonical SMILES for N-[2-(furan-3-yl)ethyl]-1-methylpyrazole-4-sulfonamide is Cn1cc(S(=O)(=O)NCCc2ccoc2)cn1.
What is the InChIKey of N-[2-(furan-3-yl)ethyl]-1-methylpyrazole-4-sulfonamide?
The InChIKey is PHERFDDAAMVOJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O3S/c1-13-7-10(6-11-13)17(14,15)12-4-2-9-3-5-16-8-9/h3,5-8,12H,2,4H2,1H3.
What are the key properties of N-[2-(furan-3-yl)ethyl]-1-methylpyrazole-4-sulfonamide?
N-[2-(furan-3-yl)ethyl]-1-methylpyrazole-4-sulfonamide has a molecular weight of 255.30 g/mol, XLogP of 0.53, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(furan-3-yl)ethyl]-1-methylpyrazole-4-sulfonamide is sourced from PubChem (CID 71807049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).