N-(4-methoxyphenyl)-2-(thiophen-2-ylsulfonylamino)acetamide

C13H14N2O4S2 — CID 3240498

IUPACN-(4-methoxyphenyl)-2-(thiophen-2-ylsulfonylamino)acetamide
SMILESCOc1ccc(NC(=O)CNS(=O)(=O)c2cccs2)cc1
InChIInChI=1S/C13H14N2O4S2/c1-19-11-6-4-10(5-7-11)15-12(16)9-14-21(17,18)13-3-2-8-20-13/h2-8,14H,9H2,1H3,(H,15,16)
InChIKeyOQBLVYRUBWJTHU-UHFFFAOYSA-N
MW326.40 g/mol
LogP1.67
Rot. Bonds6

About N-(4-methoxyphenyl)-2-(thiophen-2-ylsulfonylamino)acetamide

N-(4-methoxyphenyl)-2-(thiophen-2-ylsulfonylamino)acetamide (PubChem CID 3240498) has the molecular formula C13H14N2O4S2 and a molecular weight of 326.40 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-2-(thiophen-2-ylsulfonylamino)acetamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-2-(thiophen-2-ylsulfonylamino)acetamide
PubChem CID3240498
Molecular FormulaC13H14N2O4S2
Molecular Weight326.40 g/mol
Exact Mass326.04
IUPAC NameN-(4-methoxyphenyl)-2-(thiophen-2-ylsulfonylamino)acetamide
SMILESCOc1ccc(NC(=O)CNS(=O)(=O)c2cccs2)cc1
InChIInChI=1S/C13H14N2O4S2/c1-19-11-6-4-10(5-7-11)15-12(16)9-14-21(17,18)13-3-2-8-20-13/h2-8,14H,9H2,1H3,(H,15,16)
InChIKeyOQBLVYRUBWJTHU-UHFFFAOYSA-N
XLogP1.67
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-(thiophene-2-sulfonyl)-N-[4-(trifluoromethoxy)phenyl]piperidine-4-carboxamide
CID 15988672
2-[(4-fluorophenyl)sulfonyl]-N-(4-methoxyphenyl)acetamide
CID 1486369
3-amino-4-(isopropylsulfonyl)-N-(4-methoxyphenyl)-2-thiophenecarboxamide
CID 2815287
N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-2-thiophen-2-ylacetamide
CID 4045486
2-(2-methoxy-N-thiophen-2-ylsulfonylanilino)-N-(2-methylcyclohexyl)acetamide
CID 4297432
N-(4-ethoxyphenyl)-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide
CID 4810603
N-(4-methoxyphenyl)-4-{[(thien-2-ylsulfonyl)amino]methyl}cyclohexanecarboxamide
CID 5322907
1-(4-Methoxyphenyl)-4-{[1-(thien-2-ylsulfonyl)piperidin-4-yl]carbonyl}piperazine
CID 15988659
3-(5-bromothiophen-2-yl)sulfonyl-N-(4-ethoxyphenyl)propanamide
CID 15988713
N-(4-Methoxyphenyl)-2-(N-methyl5-bromothiophene-2-sulfonamido)acetamide
CID 15995263
4-[Butyryl(thien-2-ylsulfonyl)amino]phenyl butyrate
CID 5133952
2-amino-N-[4-[4-(thiiran-2-ylmethylsulfonyl)phenoxy]phenyl]acetamide
CID 53378637

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-2-(thiophen-2-ylsulfonylamino)acetamide?
The IUPAC name of N-(4-methoxyphenyl)-2-(thiophen-2-ylsulfonylamino)acetamide (CID 3240498) is N-(4-methoxyphenyl)-2-(thiophen-2-ylsulfonylamino)acetamide.
What is the SMILES notation for N-(4-methoxyphenyl)-2-(thiophen-2-ylsulfonylamino)acetamide?
The canonical SMILES for N-(4-methoxyphenyl)-2-(thiophen-2-ylsulfonylamino)acetamide is COc1ccc(NC(=O)CNS(=O)(=O)c2cccs2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-2-(thiophen-2-ylsulfonylamino)acetamide?
The InChIKey is OQBLVYRUBWJTHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O4S2/c1-19-11-6-4-10(5-7-11)15-12(16)9-14-21(17,18)13-3-2-8-20-13/h2-8,14H,9H2,1H3,(H,15,16).
What are the key properties of N-(4-methoxyphenyl)-2-(thiophen-2-ylsulfonylamino)acetamide?
N-(4-methoxyphenyl)-2-(thiophen-2-ylsulfonylamino)acetamide has a molecular weight of 326.40 g/mol, XLogP of 1.67, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-2-(thiophen-2-ylsulfonylamino)acetamide is sourced from PubChem (CID 3240498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).