N-ethyl-N-(2,4,6-trimethylphenyl)thiophene-2-sulfonamide

C15H19NO2S2 — CID 100550599

IUPACN-ethyl-N-(2,4,6-trimethylphenyl)thiophene-2-sulfonamide
SMILESCCN(c1c(C)cc(C)cc1C)S(=O)(=O)c1cccs1
InChIInChI=1S/C15H19NO2S2/c1-5-16(20(17,18)14-7-6-8-19-14)15-12(3)9-11(2)10-13(15)4/h6-10H,5H2,1-4H3
InChIKeyFNRLQHOXTYTHOD-UHFFFAOYSA-N
MW309.46 g/mol
LogP3.89
Rot. Bonds4

About N-ethyl-N-(2,4,6-trimethylphenyl)thiophene-2-sulfonamide

N-ethyl-N-(2,4,6-trimethylphenyl)thiophene-2-sulfonamide (PubChem CID 100550599) has the molecular formula C15H19NO2S2 and a molecular weight of 309.46 g/mol. Its IUPAC name is N-ethyl-N-(2,4,6-trimethylphenyl)thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-ethyl-N-(2,4,6-trimethylphenyl)thiophene-2-sulfonamide
PubChem CID100550599
Molecular FormulaC15H19NO2S2
Molecular Weight309.46 g/mol
Exact Mass309.09
IUPAC NameN-ethyl-N-(2,4,6-trimethylphenyl)thiophene-2-sulfonamide
SMILESCCN(c1c(C)cc(C)cc1C)S(=O)(=O)c1cccs1
InChIInChI=1S/C15H19NO2S2/c1-5-16(20(17,18)14-7-6-8-19-14)15-12(3)9-11(2)10-13(15)4/h6-10H,5H2,1-4H3
InChIKeyFNRLQHOXTYTHOD-UHFFFAOYSA-N
XLogP3.89
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.46
LogP ≤ 53.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

ethyl 2-(2,4,6-trimethyl-N-thiophen-2-ylsulfonylanilino)acetate
CID 100550650
N-(2-aminophenyl)-N-ethylthiophene-2-sulfonamide
CID 62102311
N-(3-amino-4-methoxyphenyl)-N-ethylthiophene-2-sulfonamide
CID 39452560
N-ethyl-N-methylthiophene-2-sulfonamide;hydrochloride
CID 130616398
3-amino-4-[ethyl(thiophen-2-ylsulfonyl)amino]benzoic acid
CID 63119138
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-ethylthiophene-2-sulfonamide
CID 100550390
N-(4-bromo-3-chlorophenyl)-N-ethylthiophene-2-sulfonamide
CID 100551123
N-ethyl-N-(2-formyl-4,5-dimethyl-1H-indol-7-yl)thiophene-2-sulfonamide
CID 89145708
N-[4-chloro-3-(trifluoromethyl)phenyl]-N-ethylthiophene-2-sulfonamide
CID 100550027
ethyl 2-(4-methyl-N-thiophen-2-ylsulfonylanilino)acetate
CID 100547151
N-(difluoromethyl)-N-(2,4-dimethylphenyl)thiophene-2-sulfonamide
CID 2342115
N-(2-methylphenyl)-N-prop-2-enylthiophene-2-sulfonamide
CID 100547015

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(2,4,6-trimethylphenyl)thiophene-2-sulfonamide?
The IUPAC name of N-ethyl-N-(2,4,6-trimethylphenyl)thiophene-2-sulfonamide (CID 100550599) is N-ethyl-N-(2,4,6-trimethylphenyl)thiophene-2-sulfonamide.
What is the SMILES notation for N-ethyl-N-(2,4,6-trimethylphenyl)thiophene-2-sulfonamide?
The canonical SMILES for N-ethyl-N-(2,4,6-trimethylphenyl)thiophene-2-sulfonamide is CCN(c1c(C)cc(C)cc1C)S(=O)(=O)c1cccs1.
What is the InChIKey of N-ethyl-N-(2,4,6-trimethylphenyl)thiophene-2-sulfonamide?
The InChIKey is FNRLQHOXTYTHOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO2S2/c1-5-16(20(17,18)14-7-6-8-19-14)15-12(3)9-11(2)10-13(15)4/h6-10H,5H2,1-4H3.
What are the key properties of N-ethyl-N-(2,4,6-trimethylphenyl)thiophene-2-sulfonamide?
N-ethyl-N-(2,4,6-trimethylphenyl)thiophene-2-sulfonamide has a molecular weight of 309.46 g/mol, XLogP of 3.89, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(2,4,6-trimethylphenyl)thiophene-2-sulfonamide is sourced from PubChem (CID 100550599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).