N-(2-phenyl-1-thiophen-2-ylethyl)ethanesulfonamide

C14H17NO2S2 — CID 56791791

IUPACN-(2-phenyl-1-thiophen-2-ylethyl)ethanesulfonamide
SMILESCCS(=O)(=O)NC(Cc1ccccc1)c1cccs1
InChIInChI=1S/C14H17NO2S2/c1-2-19(16,17)15-13(14-9-6-10-18-14)11-12-7-4-3-5-8-12/h3-10,13,15H,2,11H2,1H3
InChIKeyJUGXYEYCQGSOPT-UHFFFAOYSA-N
MW295.43 g/mol
LogP2.97
Rot. Bonds6

About N-(2-phenyl-1-thiophen-2-ylethyl)ethanesulfonamide

N-(2-phenyl-1-thiophen-2-ylethyl)ethanesulfonamide (PubChem CID 56791791) has the molecular formula C14H17NO2S2 and a molecular weight of 295.43 g/mol. Its IUPAC name is N-(2-phenyl-1-thiophen-2-ylethyl)ethanesulfonamide.

Molecular Properties

Compound NameN-(2-phenyl-1-thiophen-2-ylethyl)ethanesulfonamide
PubChem CID56791791
Molecular FormulaC14H17NO2S2
Molecular Weight295.43 g/mol
Exact Mass295.07
IUPAC NameN-(2-phenyl-1-thiophen-2-ylethyl)ethanesulfonamide
SMILESCCS(=O)(=O)NC(Cc1ccccc1)c1cccs1
InChIInChI=1S/C14H17NO2S2/c1-2-19(16,17)15-13(14-9-6-10-18-14)11-12-7-4-3-5-8-12/h3-10,13,15H,2,11H2,1H3
InChIKeyJUGXYEYCQGSOPT-UHFFFAOYSA-N
XLogP2.97
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.43
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-thiophen-2-ylpropyl)ethanesulfonamide
CID 47372817
N-ethyl-2-phenyl-1-thiophen-2-ylethanamine;hydrochloride
CID 3061989
N-(2-phenyl-1-thiophen-2-ylethyl)pyrrolidine-1-sulfonamide
CID 176725551
5-chloro-1-methyl-N-(2-phenyl-1-thiophen-2-ylethyl)imidazole-4-sulfonamide
CID 166209049
N-(1-amino-2-phenylethyl)ethanesulfonamide
CID 69257411
N-(1-chloro-3-phenylpropan-2-yl)ethanesulfonamide
CID 65030823
2-[1-(sulfamoylamino)propyl]thiophene
CID 112686147
(2-phenyl-1-thiophen-2-ylethyl) methanesulfonate
CID 90963221
4-amino-N-(2-phenyl-1-thiophen-2-ylethyl)pentanamide
CID 120563010
N-[(1S)-1-(5-ethylsulfonyl-1,3,4-oxadiazol-2-yl)-2-phenylethyl]ethanesulfonamide
CID 9185655
[2-(4-ethylphenyl)-1-thiophen-2-ylethyl]hydrazine
CID 105193509
1-benzyl-3-(1-thiophen-2-ylpropyl)urea
CID 47322594

Frequently Asked Questions

What is the IUPAC name of N-(2-phenyl-1-thiophen-2-ylethyl)ethanesulfonamide?
The IUPAC name of N-(2-phenyl-1-thiophen-2-ylethyl)ethanesulfonamide (CID 56791791) is N-(2-phenyl-1-thiophen-2-ylethyl)ethanesulfonamide.
What is the SMILES notation for N-(2-phenyl-1-thiophen-2-ylethyl)ethanesulfonamide?
The canonical SMILES for N-(2-phenyl-1-thiophen-2-ylethyl)ethanesulfonamide is CCS(=O)(=O)NC(Cc1ccccc1)c1cccs1.
What is the InChIKey of N-(2-phenyl-1-thiophen-2-ylethyl)ethanesulfonamide?
The InChIKey is JUGXYEYCQGSOPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO2S2/c1-2-19(16,17)15-13(14-9-6-10-18-14)11-12-7-4-3-5-8-12/h3-10,13,15H,2,11H2,1H3.
What are the key properties of N-(2-phenyl-1-thiophen-2-ylethyl)ethanesulfonamide?
N-(2-phenyl-1-thiophen-2-ylethyl)ethanesulfonamide has a molecular weight of 295.43 g/mol, XLogP of 2.97, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenyl-1-thiophen-2-ylethyl)ethanesulfonamide is sourced from PubChem (CID 56791791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).