N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-2-thiophen-2-ylacetamide

C18H22N2O4S2 — CID 3918219

IUPACN-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-2-thiophen-2-ylacetamide
SMILESCOc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)Cc1cccs1
InChIInChI=1S/C18H22N2O4S2/c1-24-17-8-7-15(26(22,23)20-9-3-2-4-10-20)13-16(17)19-18(21)12-14-6-5-11-25-14/h5-8,11,13H,2-4,9-10,12H2,1H3,(H,19,21)
InChIKeyPZZBTOIROXOXBY-UHFFFAOYSA-N
MW394.52 g/mol
LogP3.11
Rot. Bonds6

About N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-2-thiophen-2-ylacetamide

N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-2-thiophen-2-ylacetamide (PubChem CID 3918219) has the molecular formula C18H22N2O4S2 and a molecular weight of 394.52 g/mol. Its IUPAC name is N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-2-thiophen-2-ylacetamide.

Molecular Properties

Compound NameN-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-2-thiophen-2-ylacetamide
PubChem CID3918219
Molecular FormulaC18H22N2O4S2
Molecular Weight394.52 g/mol
Exact Mass394.10
IUPAC NameN-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-2-thiophen-2-ylacetamide
SMILESCOc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)Cc1cccs1
InChIInChI=1S/C18H22N2O4S2/c1-24-17-8-7-15(26(22,23)20-9-3-2-4-10-20)13-16(17)19-18(21)12-14-6-5-11-25-14/h5-8,11,13H,2-4,9-10,12H2,1H3,(H,19,21)
InChIKeyPZZBTOIROXOXBY-UHFFFAOYSA-N
XLogP3.11
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.52
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

Thiophene-2-carboxylic acid {4-[4-(2-methoxy-phenyl)-piperazin-1-yl]-butyl}-amide
CID 10248783
N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide
CID 15945391
N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-4-phenoxybutanamide
CID 3354639
N-[5-(dimethylsulfamoyl)-2-methylphenyl]-2-(2-methoxy-N-thiophen-2-ylsulfonylanilino)acetamide
CID 3617239
N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-2-thiophen-2-ylacetamide
CID 4045486
N-[5-[ethyl(phenyl)sulfamoyl]-2-methoxyphenyl]cyclobutanecarboxamide
CID 4800134
[2-(2-Methoxy-5-morpholin-4-ylsulfonylanilino)-2-oxoethyl] 5-nitrothiophene-2-carboxylate
CID 4843731
1-[(2,5-Dimethylthiophen-3-yl)sulfonyl]-4-(2-methoxyphenyl)piperazine
CID 1520541
5-Methyl-thiophene-2-carboxylic acid {4-[4-(2-methoxy-phenyl)-piperazin-1-yl]-butyl}-amide
CID 10091635
N-{2-[4-(2-Methoxy-phenyl)-piperazin-1-yl]-ethyl}-2-thiophen-3-yl-acetamide
CID 10247900
5-Methyl-thiophene-2-carboxylic acid {2-[4-(2-methoxy-phenyl)-piperazin-1-yl]-ethyl}-amide
CID 10473644
N-{4-[4-(2-Methoxy-phenyl)-piperazin-1-yl]-butyl}-2-thiophen-3-yl-acetamide
CID 10475338

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-2-thiophen-2-ylacetamide?
The IUPAC name of N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-2-thiophen-2-ylacetamide (CID 3918219) is N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-2-thiophen-2-ylacetamide.
What is the SMILES notation for N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-2-thiophen-2-ylacetamide?
The canonical SMILES for N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-2-thiophen-2-ylacetamide is COc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)Cc1cccs1.
What is the InChIKey of N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-2-thiophen-2-ylacetamide?
The InChIKey is PZZBTOIROXOXBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O4S2/c1-24-17-8-7-15(26(22,23)20-9-3-2-4-10-20)13-16(17)19-18(21)12-14-6-5-11-25-14/h5-8,11,13H,2-4,9-10,12H2,1H3,(H,19,21).
What are the key properties of N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-2-thiophen-2-ylacetamide?
N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-2-thiophen-2-ylacetamide has a molecular weight of 394.52 g/mol, XLogP of 3.11, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-2-thiophen-2-ylacetamide is sourced from PubChem (CID 3918219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).