2-(4-methoxyphenyl)-N-(3-piperidin-1-ylsulfonylphenyl)acetamide

C20H24N2O4S — CID 4009667

IUPAC2-(4-methoxyphenyl)-N-(3-piperidin-1-ylsulfonylphenyl)acetamide
SMILESCOc1ccc(CC(=O)Nc2cccc(S(=O)(=O)N3CCCCC3)c2)cc1
InChIInChI=1S/C20H24N2O4S/c1-26-18-10-8-16(9-11-18)14-20(23)21-17-6-5-7-19(15-17)27(24,25)22-12-3-2-4-13-22/h5-11,15H,2-4,12-14H2,1H3,(H,21,23)
InChIKeyDKCPQJNBOLUDJT-UHFFFAOYSA-N
MW388.49 g/mol
LogP3.05
Rot. Bonds6

About 2-(4-methoxyphenyl)-N-(3-piperidin-1-ylsulfonylphenyl)acetamide

2-(4-methoxyphenyl)-N-(3-piperidin-1-ylsulfonylphenyl)acetamide (PubChem CID 4009667) has the molecular formula C20H24N2O4S and a molecular weight of 388.49 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-N-(3-piperidin-1-ylsulfonylphenyl)acetamide.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-N-(3-piperidin-1-ylsulfonylphenyl)acetamide
PubChem CID4009667
Molecular FormulaC20H24N2O4S
Molecular Weight388.49 g/mol
Exact Mass388.15
IUPAC Name2-(4-methoxyphenyl)-N-(3-piperidin-1-ylsulfonylphenyl)acetamide
SMILESCOc1ccc(CC(=O)Nc2cccc(S(=O)(=O)N3CCCCC3)c2)cc1
InChIInChI=1S/C20H24N2O4S/c1-26-18-10-8-16(9-11-18)14-20(23)21-17-6-5-7-19(15-17)27(24,25)22-12-3-2-4-13-22/h5-11,15H,2-4,12-14H2,1H3,(H,21,23)
InChIKeyDKCPQJNBOLUDJT-UHFFFAOYSA-N
XLogP3.05
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.49
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Nalpha-{[4-(4-aminobenzene-1-sulfonyl)-2-oxopiperazin-1-yl]acetyl}-N-(4-methoxyphenyl)-N-methyl-L-phenylalaninamide
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2-(4-methoxyphenyl)-N-(4-sulfamoylphenyl)acetamide
CID 822776
N-(2-methoxyphenyl)-4-[(2-methoxyphenyl)-methylsulfamoyl]benzamide
CID 2083341
3,5-bis(fluoranyl)-~{N}-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]benzamide
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CID 2248175
2-(4-methoxyphenyl)-N-(4-sulfamoylbenzyl)acetamide
CID 4578038
N-(2-fluoro-4-sulfamoylphenyl)-2-(4-methoxyphenyl)acetamide
CID 71764402
(2E)-2-[(4-methoxyphenyl)methylidene]-3-oxo-N-(4-sulfamoylphenyl)butanamide
CID 155521462
3-[[(E)-3-(4-methoxyphenyl)-3-oxoprop-1-enyl]amino]benzenesulfonamide
CID 168276560
N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-(4-methylphenoxy)acetamide
CID 3647605
N-[[4-[(2-methoxy-5-piperidin-1-ylsulfonylphenyl)sulfamoyl]phenyl]methyl]acetamide
CID 4689808
2-(3,4-dimethylphenyl)-N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)acetamide
CID 4798488

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-N-(3-piperidin-1-ylsulfonylphenyl)acetamide?
The IUPAC name of 2-(4-methoxyphenyl)-N-(3-piperidin-1-ylsulfonylphenyl)acetamide (CID 4009667) is 2-(4-methoxyphenyl)-N-(3-piperidin-1-ylsulfonylphenyl)acetamide.
What is the SMILES notation for 2-(4-methoxyphenyl)-N-(3-piperidin-1-ylsulfonylphenyl)acetamide?
The canonical SMILES for 2-(4-methoxyphenyl)-N-(3-piperidin-1-ylsulfonylphenyl)acetamide is COc1ccc(CC(=O)Nc2cccc(S(=O)(=O)N3CCCCC3)c2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-N-(3-piperidin-1-ylsulfonylphenyl)acetamide?
The InChIKey is DKCPQJNBOLUDJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O4S/c1-26-18-10-8-16(9-11-18)14-20(23)21-17-6-5-7-19(15-17)27(24,25)22-12-3-2-4-13-22/h5-11,15H,2-4,12-14H2,1H3,(H,21,23).
What are the key properties of 2-(4-methoxyphenyl)-N-(3-piperidin-1-ylsulfonylphenyl)acetamide?
2-(4-methoxyphenyl)-N-(3-piperidin-1-ylsulfonylphenyl)acetamide has a molecular weight of 388.49 g/mol, XLogP of 3.05, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-N-(3-piperidin-1-ylsulfonylphenyl)acetamide is sourced from PubChem (CID 4009667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).