(2S)-N-[2-(phenylsulfamoyl)ethyl]-2-thiophen-2-ylpropanamide

C15H18N2O3S2 — CID 97215141

IUPAC(2S)-N-[2-(phenylsulfamoyl)ethyl]-2-thiophen-2-ylpropanamide
SMILESC[C@@H](C(=O)NCCS(=O)(=O)Nc1ccccc1)c1cccs1
InChIInChI=1S/C15H18N2O3S2/c1-12(14-8-5-10-21-14)15(18)16-9-11-22(19,20)17-13-6-3-2-4-7-13/h2-8,10,12,17H,9,11H2,1H3,(H,16,18)/t12-/m1/s1
InChIKeyUFLZQWOUDWORRW-GFCCVEGCSA-N
MW338.45 g/mol
LogP2.41
Rot. Bonds7

About (2S)-N-[2-(phenylsulfamoyl)ethyl]-2-thiophen-2-ylpropanamide

(2S)-N-[2-(phenylsulfamoyl)ethyl]-2-thiophen-2-ylpropanamide (PubChem CID 97215141) has the molecular formula C15H18N2O3S2 and a molecular weight of 338.45 g/mol. Its IUPAC name is (2S)-N-[2-(phenylsulfamoyl)ethyl]-2-thiophen-2-ylpropanamide.

Molecular Properties

Compound Name(2S)-N-[2-(phenylsulfamoyl)ethyl]-2-thiophen-2-ylpropanamide
PubChem CID97215141
Molecular FormulaC15H18N2O3S2
Molecular Weight338.45 g/mol
Exact Mass338.08
IUPAC Name(2S)-N-[2-(phenylsulfamoyl)ethyl]-2-thiophen-2-ylpropanamide
SMILESC[C@@H](C(=O)NCCS(=O)(=O)Nc1ccccc1)c1cccs1
InChIInChI=1S/C15H18N2O3S2/c1-12(14-8-5-10-21-14)15(18)16-9-11-22(19,20)17-13-6-3-2-4-7-13/h2-8,10,12,17H,9,11H2,1H3,(H,16,18)/t12-/m1/s1
InChIKeyUFLZQWOUDWORRW-GFCCVEGCSA-N
XLogP2.41
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.45
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-ethyl-N-[2-(phenylsulfamoyl)ethyl]butanamide
CID 110408207
N-(2-amino-2-ethylbutyl)-2-thiophen-2-ylpropanamide
CID 119641253
(2R)-N-[2-(2,6-dioxopiperidin-1-yl)ethyl]-2-thiophen-2-ylpropanamide
CID 95905607
2-bromo-N-[2-(phenylsulfamoyl)ethyl]benzamide
CID 110408216
2-(4-methoxyphenyl)-N-[2-(phenylsulfamoyl)ethyl]acetamide
CID 110601294
2-(1,3-dioxoisoindol-2-yl)-N-[2-(phenylsulfamoyl)ethyl]acetamide
CID 110601301
N-phenyl-1-thiophen-2-ylmethanesulfonamide
CID 67649558
4-(2-methylphenyl)-4-oxo-N-[2-(phenylsulfamoyl)ethyl]butanamide
CID 110606798
N-[(4-hydroxypyrrolidin-3-yl)methyl]-2-thiophen-2-ylpropanamide
CID 120948169
3-bromo-N-[2-(phenylsulfamoyl)ethyl]benzamide
CID 110601282
3-methyl-N-[2-(phenylsulfamoyl)ethyl]cyclohexane-1-carboxamide
CID 84584646
tert-butyl N-[2-methyl-1-[[(2R)-2-thiophen-2-ylpropanoyl]amino]propan-2-yl]carbamate
CID 95933406

Frequently Asked Questions

What is the IUPAC name of (2S)-N-[2-(phenylsulfamoyl)ethyl]-2-thiophen-2-ylpropanamide?
The IUPAC name of (2S)-N-[2-(phenylsulfamoyl)ethyl]-2-thiophen-2-ylpropanamide (CID 97215141) is (2S)-N-[2-(phenylsulfamoyl)ethyl]-2-thiophen-2-ylpropanamide.
What is the SMILES notation for (2S)-N-[2-(phenylsulfamoyl)ethyl]-2-thiophen-2-ylpropanamide?
The canonical SMILES for (2S)-N-[2-(phenylsulfamoyl)ethyl]-2-thiophen-2-ylpropanamide is C[C@@H](C(=O)NCCS(=O)(=O)Nc1ccccc1)c1cccs1.
What is the InChIKey of (2S)-N-[2-(phenylsulfamoyl)ethyl]-2-thiophen-2-ylpropanamide?
The InChIKey is UFLZQWOUDWORRW-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H18N2O3S2/c1-12(14-8-5-10-21-14)15(18)16-9-11-22(19,20)17-13-6-3-2-4-7-13/h2-8,10,12,17H,9,11H2,1H3,(H,16,18)/t12-/m1/s1.
What are the key properties of (2S)-N-[2-(phenylsulfamoyl)ethyl]-2-thiophen-2-ylpropanamide?
(2S)-N-[2-(phenylsulfamoyl)ethyl]-2-thiophen-2-ylpropanamide has a molecular weight of 338.45 g/mol, XLogP of 2.41, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-[2-(phenylsulfamoyl)ethyl]-2-thiophen-2-ylpropanamide is sourced from PubChem (CID 97215141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).