N-ethylidenethiophene-2-sulfonamide

C6H7NO2S2 — CID 141046508

IUPACN-ethylidenethiophene-2-sulfonamide
SMILESCC=NS(=O)(=O)c1cccs1
InChIInChI=1S/C6H7NO2S2/c1-2-7-11(8,9)6-4-3-5-10-6/h2-5H,1H3
InChIKeyUINQPABAACAOQV-UHFFFAOYSA-N
MW189.26 g/mol
LogP1.53
Rot. Bonds2

About N-ethylidenethiophene-2-sulfonamide

N-ethylidenethiophene-2-sulfonamide (PubChem CID 141046508) has the molecular formula C6H7NO2S2 and a molecular weight of 189.26 g/mol. Its IUPAC name is N-ethylidenethiophene-2-sulfonamide.

Molecular Properties

Compound NameN-ethylidenethiophene-2-sulfonamide
PubChem CID141046508
Molecular FormulaC6H7NO2S2
Molecular Weight189.26 g/mol
Exact Mass188.99
IUPAC NameN-ethylidenethiophene-2-sulfonamide
SMILESCC=NS(=O)(=O)c1cccs1
InChIInChI=1S/C6H7NO2S2/c1-2-7-11(8,9)6-4-3-5-10-6/h2-5H,1H3
InChIKeyUINQPABAACAOQV-UHFFFAOYSA-N
XLogP1.53
TPSA46.50 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 51.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

N-(thiophen-2-ylmethylidene)thiophene-2-sulfonamide
CID 693839
N-sulfonylthiophene-2-sulfonamide
CID 88522112
N-[(2-hydroxyphenyl)methylidene]thiophene-2-sulfonamide
CID 687527
thiophene-2-(18F)sulfonyl fluoride
CID 72736656
2-thiophen-2-ylsulfonylsulfonylthiophene
CID 141485126
methyl N'-thiophen-2-ylsulfonylcarbamimidate
CID 74002349
(NZ)-N-[(3,5-dichloro-4-ethoxyphenyl)methylidene]thiophene-2-sulfonamide
CID 110518583
ethane;thiophene-2-sulfonyl chloride
CID 91564390
methyl thiophene-2-sulfonate
CID 56986285
(NZ)-N-[(3-ethoxy-2-methoxyphenyl)methylidene]thiophene-2-sulfonamide
CID 110518625
N-benzhydrylidenethiophene-2-sulfonamide
CID 176730447
2-propan-2-ylsulfonylthiophene
CID 22953694

Frequently Asked Questions

What is the IUPAC name of N-ethylidenethiophene-2-sulfonamide?
The IUPAC name of N-ethylidenethiophene-2-sulfonamide (CID 141046508) is N-ethylidenethiophene-2-sulfonamide.
What is the SMILES notation for N-ethylidenethiophene-2-sulfonamide?
The canonical SMILES for N-ethylidenethiophene-2-sulfonamide is CC=NS(=O)(=O)c1cccs1.
What is the InChIKey of N-ethylidenethiophene-2-sulfonamide?
The InChIKey is UINQPABAACAOQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7NO2S2/c1-2-7-11(8,9)6-4-3-5-10-6/h2-5H,1H3.
What are the key properties of N-ethylidenethiophene-2-sulfonamide?
N-ethylidenethiophene-2-sulfonamide has a molecular weight of 189.26 g/mol, XLogP of 1.53, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethylidenethiophene-2-sulfonamide is sourced from PubChem (CID 141046508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).