N-(2-phenyl-2-thiophen-2-ylsulfonylethyl)benzamide

C19H17NO3S2 — CID 44649043

IUPACN-(2-phenyl-2-thiophen-2-ylsulfonylethyl)benzamide
SMILESO=C(NCC(c1ccccc1)S(=O)(=O)c1cccs1)c1ccccc1
InChIInChI=1S/C19H17NO3S2/c21-19(16-10-5-2-6-11-16)20-14-17(15-8-3-1-4-9-15)25(22,23)18-12-7-13-24-18/h1-13,17H,14H2,(H,20,21)
InChIKeyZSMGHEAELQZWIB-UHFFFAOYSA-N
MW371.48 g/mol
LogP3.69
Rot. Bonds6

About N-(2-phenyl-2-thiophen-2-ylsulfonylethyl)benzamide

N-(2-phenyl-2-thiophen-2-ylsulfonylethyl)benzamide (PubChem CID 44649043) has the molecular formula C19H17NO3S2 and a molecular weight of 371.48 g/mol. Its IUPAC name is N-(2-phenyl-2-thiophen-2-ylsulfonylethyl)benzamide.

Molecular Properties

Compound NameN-(2-phenyl-2-thiophen-2-ylsulfonylethyl)benzamide
PubChem CID44649043
Molecular FormulaC19H17NO3S2
Molecular Weight371.48 g/mol
Exact Mass371.06
IUPAC NameN-(2-phenyl-2-thiophen-2-ylsulfonylethyl)benzamide
SMILESO=C(NCC(c1ccccc1)S(=O)(=O)c1cccs1)c1ccccc1
InChIInChI=1S/C19H17NO3S2/c21-19(16-10-5-2-6-11-16)20-14-17(15-8-3-1-4-9-15)25(22,23)18-12-7-13-24-18/h1-13,17H,14H2,(H,20,21)
InChIKeyZSMGHEAELQZWIB-UHFFFAOYSA-N
XLogP3.69
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 ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(4-fluorophenyl)-2-thiophen-2-ylsulfonylethyl]benzamide
CID 44649417
4-fluoro-N-(2-phenyl-2-thiophen-2-ylsulfonylethyl)benzamide
CID 44649058
3-chloro-N-[(2R)-2-phenyl-2-thiophen-2-ylsulfonylethyl]benzamide
CID 9169004
N-(2-pyridin-3-yl-2-thiophen-2-ylsulfonylethyl)benzamide
CID 21001981
N-[(2S)-2-phenyl-2-thiophen-2-ylsulfonylethyl]-1,3-benzodioxole-5-carboxamide
CID 9168936
N-[(2R)-2-pyridin-3-yl-2-thiophen-2-ylsulfonylethyl]pyridine-3-carboxamide
CID 9152316
3-methyl-N-[(2R)-2-(4-methylphenyl)-2-thiophen-2-ylsulfonylethyl]benzamide
CID 9181313
2-phenoxy-N-[(2S)-2-phenyl-2-thiophen-2-ylsulfonylethyl]acetamide
CID 9180474
3,4-dimethyl-N-[(2S)-2-(4-methylphenyl)-2-thiophen-2-ylsulfonylethyl]benzamide
CID 9181348
3-methoxy-N-[(2S)-2-(4-methylphenyl)-2-thiophen-2-ylsulfonylethyl]benzamide
CID 9181381
N-[(2S)-2-(4-methoxyphenyl)-2-thiophen-2-ylsulfonylethyl]-3-methylbenzamide
CID 9183081
N-[(2R)-2-(4-chlorophenyl)-2-thiophen-2-ylsulfonylethyl]thiophene-2-carboxamide
CID 9184130

Frequently Asked Questions

What is the IUPAC name of N-(2-phenyl-2-thiophen-2-ylsulfonylethyl)benzamide?
The IUPAC name of N-(2-phenyl-2-thiophen-2-ylsulfonylethyl)benzamide (CID 44649043) is N-(2-phenyl-2-thiophen-2-ylsulfonylethyl)benzamide.
What is the SMILES notation for N-(2-phenyl-2-thiophen-2-ylsulfonylethyl)benzamide?
The canonical SMILES for N-(2-phenyl-2-thiophen-2-ylsulfonylethyl)benzamide is O=C(NCC(c1ccccc1)S(=O)(=O)c1cccs1)c1ccccc1.
What is the InChIKey of N-(2-phenyl-2-thiophen-2-ylsulfonylethyl)benzamide?
The InChIKey is ZSMGHEAELQZWIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17NO3S2/c21-19(16-10-5-2-6-11-16)20-14-17(15-8-3-1-4-9-15)25(22,23)18-12-7-13-24-18/h1-13,17H,14H2,(H,20,21).
What are the key properties of N-(2-phenyl-2-thiophen-2-ylsulfonylethyl)benzamide?
N-(2-phenyl-2-thiophen-2-ylsulfonylethyl)benzamide has a molecular weight of 371.48 g/mol, XLogP of 3.69, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenyl-2-thiophen-2-ylsulfonylethyl)benzamide is sourced from PubChem (CID 44649043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).