N-[2-(benzenesulfonyl)ethyl]-3-phenylthiophene-2-carboxamide

C19H17NO3S2 — CID 60515488

IUPACN-[2-(benzenesulfonyl)ethyl]-3-phenylthiophene-2-carboxamide
SMILESO=C(NCCS(=O)(=O)c1ccccc1)c1sccc1-c1ccccc1
InChIInChI=1S/C19H17NO3S2/c21-19(18-17(11-13-24-18)15-7-3-1-4-8-15)20-12-14-25(22,23)16-9-5-2-6-10-16/h1-11,13H,12,14H2,(H,20,21)
InChIKeyUZEUKSPSJHKDIA-UHFFFAOYSA-N
MW371.48 g/mol
LogP3.62
Rot. Bonds6

About N-[2-(benzenesulfonyl)ethyl]-3-phenylthiophene-2-carboxamide

N-[2-(benzenesulfonyl)ethyl]-3-phenylthiophene-2-carboxamide (PubChem CID 60515488) has the molecular formula C19H17NO3S2 and a molecular weight of 371.48 g/mol. Its IUPAC name is N-[2-(benzenesulfonyl)ethyl]-3-phenylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-[2-(benzenesulfonyl)ethyl]-3-phenylthiophene-2-carboxamide
PubChem CID60515488
Molecular FormulaC19H17NO3S2
Molecular Weight371.48 g/mol
Exact Mass371.06
IUPAC NameN-[2-(benzenesulfonyl)ethyl]-3-phenylthiophene-2-carboxamide
SMILESO=C(NCCS(=O)(=O)c1ccccc1)c1sccc1-c1ccccc1
InChIInChI=1S/C19H17NO3S2/c21-19(18-17(11-13-24-18)15-7-3-1-4-8-15)20-12-14-25(22,23)16-9-5-2-6-10-16/h1-11,13H,12,14H2,(H,20,21)
InChIKeyUZEUKSPSJHKDIA-UHFFFAOYSA-N
XLogP3.62
TPSA63.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.48
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[2-(benzenesulfonyl)ethyl]-3-phenylthiophene-2-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

N-(3-aminobutyl)-3-phenylthiophene-2-carboxamide
CID 119497469
N-(2-hydroxy-2-methylpropyl)-3-phenylthiophene-2-carboxamide
CID 65110113
N-(4-phenoxybutyl)-3-phenylthiophene-2-carboxamide
CID 31671521
N-[2-[(3-nitrophenyl)sulfonylamino]ethyl]-3-phenylthiophene-2-carboxamide
CID 60593082
N-(2-amino-2-ethylbutyl)-3-phenylthiophene-2-carboxamide
CID 119641993
N-[2-(3-chlorophenyl)ethyl]-3-phenylthiophene-2-carboxamide
CID 18227178
N-(2-ethyl-2-hydroxybutyl)-3-phenylthiophene-2-carboxamide
CID 65112605
N-[[2-(methylsulfamoylmethyl)phenyl]methyl]-3-phenylthiophene-2-carboxamide
CID 17477546
N-[1-(hydroxymethyl)cyclopentyl]-3-phenylthiophene-2-carboxamide
CID 62519290
N-tert-butyl-3-phenylthiophene-2-carboxamide
CID 60629670
N-[2-(methylamino)ethyl]-3-(4-methylphenyl)thiophene-2-carboxamide
CID 119500045
N-[2-(benzenesulfonyl)ethyl]-3,4,6-trichloro-1-benzothiophene-2-carboxamide
CID 60515515

Frequently Asked Questions

What is the IUPAC name of N-[2-(benzenesulfonyl)ethyl]-3-phenylthiophene-2-carboxamide?
The IUPAC name of N-[2-(benzenesulfonyl)ethyl]-3-phenylthiophene-2-carboxamide (CID 60515488) is N-[2-(benzenesulfonyl)ethyl]-3-phenylthiophene-2-carboxamide.
What is the SMILES notation for N-[2-(benzenesulfonyl)ethyl]-3-phenylthiophene-2-carboxamide?
The canonical SMILES for N-[2-(benzenesulfonyl)ethyl]-3-phenylthiophene-2-carboxamide is O=C(NCCS(=O)(=O)c1ccccc1)c1sccc1-c1ccccc1.
What is the InChIKey of N-[2-(benzenesulfonyl)ethyl]-3-phenylthiophene-2-carboxamide?
The InChIKey is UZEUKSPSJHKDIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17NO3S2/c21-19(18-17(11-13-24-18)15-7-3-1-4-8-15)20-12-14-25(22,23)16-9-5-2-6-10-16/h1-11,13H,12,14H2,(H,20,21).
What are the key properties of N-[2-(benzenesulfonyl)ethyl]-3-phenylthiophene-2-carboxamide?
N-[2-(benzenesulfonyl)ethyl]-3-phenylthiophene-2-carboxamide has a molecular weight of 371.48 g/mol, XLogP of 3.62, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(benzenesulfonyl)ethyl]-3-phenylthiophene-2-carboxamide is sourced from PubChem (CID 60515488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).