N-(2-methoxy-5-methylphenyl)-2-phenyl-2-(thiophen-2-ylsulfonylamino)acetamide

C20H20N2O4S2 — CID 15988678

IUPACN-(2-methoxy-5-methylphenyl)-2-phenyl-2-(thiophen-2-ylsulfonylamino)acetamide
SMILESCOc1ccc(C)cc1NC(=O)C(NS(=O)(=O)c1cccs1)c1ccccc1
InChIInChI=1S/C20H20N2O4S2/c1-14-10-11-17(26-2)16(13-14)21-20(23)19(15-7-4-3-5-8-15)22-28(24,25)18-9-6-12-27-18/h3-13,19,22H,1-2H3,(H,21,23)
InChIKeyHRLXFJQFCAJGFH-UHFFFAOYSA-N
MW416.52 g/mol
LogP3.72
Rot. Bonds7

About N-(2-methoxy-5-methylphenyl)-2-phenyl-2-(thiophen-2-ylsulfonylamino)acetamide

N-(2-methoxy-5-methylphenyl)-2-phenyl-2-(thiophen-2-ylsulfonylamino)acetamide (PubChem CID 15988678) has the molecular formula C20H20N2O4S2 and a molecular weight of 416.52 g/mol. Its IUPAC name is N-(2-methoxy-5-methylphenyl)-2-phenyl-2-(thiophen-2-ylsulfonylamino)acetamide.

Molecular Properties

Compound NameN-(2-methoxy-5-methylphenyl)-2-phenyl-2-(thiophen-2-ylsulfonylamino)acetamide
PubChem CID15988678
Molecular FormulaC20H20N2O4S2
Molecular Weight416.52 g/mol
Exact Mass416.09
IUPAC NameN-(2-methoxy-5-methylphenyl)-2-phenyl-2-(thiophen-2-ylsulfonylamino)acetamide
SMILESCOc1ccc(C)cc1NC(=O)C(NS(=O)(=O)c1cccs1)c1ccccc1
InChIInChI=1S/C20H20N2O4S2/c1-14-10-11-17(26-2)16(13-14)21-20(23)19(15-7-4-3-5-8-15)22-28(24,25)18-9-6-12-27-18/h3-13,19,22H,1-2H3,(H,21,23)
InChIKeyHRLXFJQFCAJGFH-UHFFFAOYSA-N
XLogP3.72
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.52
LogP ≤ 53.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[5-(dimethylsulfamoyl)-2-methylphenyl]-2-(2-methoxy-N-thiophen-2-ylsulfonylanilino)acetamide
CID 3617239
2-(2-methoxy-N-thiophen-2-ylsulfonylanilino)-N-(2-methylcyclohexyl)acetamide
CID 4297432
N-(3-methoxyphenyl)-4-{[(thien-2-ylsulfonyl)amino]methyl}cyclohexanecarboxamide
CID 5322906
N-(4-methoxyphenyl)-4-{[(thien-2-ylsulfonyl)amino]methyl}cyclohexanecarboxamide
CID 5322907
Flaviviruses-IN-2
CID 3378615
N-cyclohexyl-2-(2-methoxy-N-thiophen-2-ylsulfonylanilino)acetamide
CID 2089888
N-[2-(benzylsulfanyl)ethyl]-N~2~-(2-methoxyphenyl)-N~2~-(phenylsulfonyl)glycinamide
CID 2267205
N-(2-methoxyphenyl)-2-(thiophen-2-ylsulfonylamino)benzamide
CID 2329070
[2-Oxo-2-(thiophen-2-ylmethylamino)ethyl] 4-[(2-methoxyphenyl)-methylsulfamoyl]benzoate
CID 2364061
N-tert-butyl-2-(2-methoxy-N-thiophen-2-ylsulfonylanilino)acetamide
CID 2437957
N-(2-Methoxy-5-methylphenyl)-4-(thiophene-2-sulfonamido)benzamide
CID 2480580
N-[4-[(2-methoxyphenyl)sulfamoyl]phenyl]-2-thiophen-2-ylacetamide
CID 2571814

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-5-methylphenyl)-2-phenyl-2-(thiophen-2-ylsulfonylamino)acetamide?
The IUPAC name of N-(2-methoxy-5-methylphenyl)-2-phenyl-2-(thiophen-2-ylsulfonylamino)acetamide (CID 15988678) is N-(2-methoxy-5-methylphenyl)-2-phenyl-2-(thiophen-2-ylsulfonylamino)acetamide.
What is the SMILES notation for N-(2-methoxy-5-methylphenyl)-2-phenyl-2-(thiophen-2-ylsulfonylamino)acetamide?
The canonical SMILES for N-(2-methoxy-5-methylphenyl)-2-phenyl-2-(thiophen-2-ylsulfonylamino)acetamide is COc1ccc(C)cc1NC(=O)C(NS(=O)(=O)c1cccs1)c1ccccc1.
What is the InChIKey of N-(2-methoxy-5-methylphenyl)-2-phenyl-2-(thiophen-2-ylsulfonylamino)acetamide?
The InChIKey is HRLXFJQFCAJGFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O4S2/c1-14-10-11-17(26-2)16(13-14)21-20(23)19(15-7-4-3-5-8-15)22-28(24,25)18-9-6-12-27-18/h3-13,19,22H,1-2H3,(H,21,23).
What are the key properties of N-(2-methoxy-5-methylphenyl)-2-phenyl-2-(thiophen-2-ylsulfonylamino)acetamide?
N-(2-methoxy-5-methylphenyl)-2-phenyl-2-(thiophen-2-ylsulfonylamino)acetamide has a molecular weight of 416.52 g/mol, XLogP of 3.72, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-5-methylphenyl)-2-phenyl-2-(thiophen-2-ylsulfonylamino)acetamide is sourced from PubChem (CID 15988678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).