N-[1-(1H-pyrazol-5-yl)ethyl]ethenesulfonamide

C7H11N3O2S — CID 167789513

IUPACN-[1-(1H-pyrazol-5-yl)ethyl]ethenesulfonamide
SMILESC=CS(=O)(=O)NC(C)c1ccn[nH]1
InChIInChI=1S/C7H11N3O2S/c1-3-13(11,12)10-6(2)7-4-5-8-9-7/h3-6,10H,1H2,2H3,(H,8,9)
InChIKeyODUBVRZORRIMFI-UHFFFAOYSA-N
MW201.25 g/mol
LogP0.53
Rot. Bonds4

About N-[1-(1H-pyrazol-5-yl)ethyl]ethenesulfonamide

N-[1-(1H-pyrazol-5-yl)ethyl]ethenesulfonamide (PubChem CID 167789513) has the molecular formula C7H11N3O2S and a molecular weight of 201.25 g/mol. Its IUPAC name is N-[1-(1H-pyrazol-5-yl)ethyl]ethenesulfonamide.

Molecular Properties

Compound NameN-[1-(1H-pyrazol-5-yl)ethyl]ethenesulfonamide
PubChem CID167789513
Molecular FormulaC7H11N3O2S
Molecular Weight201.25 g/mol
Exact Mass201.06
IUPAC NameN-[1-(1H-pyrazol-5-yl)ethyl]ethenesulfonamide
SMILESC=CS(=O)(=O)NC(C)c1ccn[nH]1
InChIInChI=1S/C7H11N3O2S/c1-3-13(11,12)10-6(2)7-4-5-8-9-7/h3-6,10H,1H2,2H3,(H,8,9)
InChIKeyODUBVRZORRIMFI-UHFFFAOYSA-N
XLogP0.53
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.25
LogP ≤ 50.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[1-(1H-pyrazol-5-yl)ethyl]ethenesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[1-(1H-pyrazol-5-yl)ethyl]ethenesulfonamide?
The IUPAC name of N-[1-(1H-pyrazol-5-yl)ethyl]ethenesulfonamide (CID 167789513) is N-[1-(1H-pyrazol-5-yl)ethyl]ethenesulfonamide.
What is the SMILES notation for N-[1-(1H-pyrazol-5-yl)ethyl]ethenesulfonamide?
The canonical SMILES for N-[1-(1H-pyrazol-5-yl)ethyl]ethenesulfonamide is C=CS(=O)(=O)NC(C)c1ccn[nH]1.
What is the InChIKey of N-[1-(1H-pyrazol-5-yl)ethyl]ethenesulfonamide?
The InChIKey is ODUBVRZORRIMFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O2S/c1-3-13(11,12)10-6(2)7-4-5-8-9-7/h3-6,10H,1H2,2H3,(H,8,9).
What are the key properties of N-[1-(1H-pyrazol-5-yl)ethyl]ethenesulfonamide?
N-[1-(1H-pyrazol-5-yl)ethyl]ethenesulfonamide has a molecular weight of 201.25 g/mol, XLogP of 0.53, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1H-pyrazol-5-yl)ethyl]ethenesulfonamide is sourced from PubChem (CID 167789513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).