2-(benzenesulfonyl)-N-(5-chloro-2-piperidin-1-ylphenyl)acetamide

C19H21ClN2O3S — CID 3917226

IUPAC2-(benzenesulfonyl)-N-(5-chloro-2-piperidin-1-ylphenyl)acetamide
SMILESO=C(CS(=O)(=O)c1ccccc1)Nc1cc(Cl)ccc1N1CCCCC1
InChIInChI=1S/C19H21ClN2O3S/c20-15-9-10-18(22-11-5-2-6-12-22)17(13-15)21-19(23)14-26(24,25)16-7-3-1-4-8-16/h1,3-4,7-10,13H,2,5-6,11-12,14H2,(H,21,23)
InChIKeyWSWNSIAMMRCMPB-UHFFFAOYSA-N
MW392.91 g/mol
LogP3.74
Rot. Bonds5

About 2-(benzenesulfonyl)-N-(5-chloro-2-piperidin-1-ylphenyl)acetamide

2-(benzenesulfonyl)-N-(5-chloro-2-piperidin-1-ylphenyl)acetamide (PubChem CID 3917226) has the molecular formula C19H21ClN2O3S and a molecular weight of 392.91 g/mol. Its IUPAC name is 2-(benzenesulfonyl)-N-(5-chloro-2-piperidin-1-ylphenyl)acetamide.

Molecular Properties

Compound Name2-(benzenesulfonyl)-N-(5-chloro-2-piperidin-1-ylphenyl)acetamide
PubChem CID3917226
Molecular FormulaC19H21ClN2O3S
Molecular Weight392.91 g/mol
Exact Mass392.10
IUPAC Name2-(benzenesulfonyl)-N-(5-chloro-2-piperidin-1-ylphenyl)acetamide
SMILESO=C(CS(=O)(=O)c1ccccc1)Nc1cc(Cl)ccc1N1CCCCC1
InChIInChI=1S/C19H21ClN2O3S/c20-15-9-10-18(22-11-5-2-6-12-22)17(13-15)21-19(23)14-26(24,25)16-7-3-1-4-8-16/h1,3-4,7-10,13H,2,5-6,11-12,14H2,(H,21,23)
InChIKeyWSWNSIAMMRCMPB-UHFFFAOYSA-N
XLogP3.74
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.91
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-chlorophenyl)sulfonyl-N-(5-chloro-2-piperidin-1-ylphenyl)acetamide
CID 38705177
N-(5-chloro-2-pyrrolidin-1-ylphenyl)-2-phenylacetamide
CID 7406867
N-(5-chloro-2-piperidin-1-ylphenyl)-2-phenylmethoxyacetamide
CID 55360085
N-(5-chloro-2-piperidin-1-ylphenyl)-2-(phenylcarbamoylamino)acetamide
CID 17459535
4-amino-N-(5-chloro-2-piperidin-1-ylphenyl)butanamide
CID 119829370
N-(5-chloro-2-pyrrolidin-1-ylphenyl)-2-methoxyacetamide
CID 47108337
N-(5-chloro-2-piperidin-1-ylphenyl)-2-(2-phenylphenoxy)acetamide
CID 7922570
N-(5-chloro-2-pyrrolidin-1-ylphenyl)-2,2-diphenylacetamide
CID 7892275
2-(benzenesulfonyl)-N-[2-(4-ethylpiperazin-1-yl)phenyl]acetamide
CID 3889301
2-(benzenesulfonyl)-N-(4-pyrrolidin-1-ylphenyl)acetamide
CID 4596496
N-(5-chloro-2-piperidin-1-ylphenyl)-2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetamide
CID 16614527
2-(benzenesulfonyl)-N-(2-benzoyl-4-chlorophenyl)acetamide
CID 4653730

Frequently Asked Questions

What is the IUPAC name of 2-(benzenesulfonyl)-N-(5-chloro-2-piperidin-1-ylphenyl)acetamide?
The IUPAC name of 2-(benzenesulfonyl)-N-(5-chloro-2-piperidin-1-ylphenyl)acetamide (CID 3917226) is 2-(benzenesulfonyl)-N-(5-chloro-2-piperidin-1-ylphenyl)acetamide.
What is the SMILES notation for 2-(benzenesulfonyl)-N-(5-chloro-2-piperidin-1-ylphenyl)acetamide?
The canonical SMILES for 2-(benzenesulfonyl)-N-(5-chloro-2-piperidin-1-ylphenyl)acetamide is O=C(CS(=O)(=O)c1ccccc1)Nc1cc(Cl)ccc1N1CCCCC1.
What is the InChIKey of 2-(benzenesulfonyl)-N-(5-chloro-2-piperidin-1-ylphenyl)acetamide?
The InChIKey is WSWNSIAMMRCMPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21ClN2O3S/c20-15-9-10-18(22-11-5-2-6-12-22)17(13-15)21-19(23)14-26(24,25)16-7-3-1-4-8-16/h1,3-4,7-10,13H,2,5-6,11-12,14H2,(H,21,23).
What are the key properties of 2-(benzenesulfonyl)-N-(5-chloro-2-piperidin-1-ylphenyl)acetamide?
2-(benzenesulfonyl)-N-(5-chloro-2-piperidin-1-ylphenyl)acetamide has a molecular weight of 392.91 g/mol, XLogP of 3.74, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzenesulfonyl)-N-(5-chloro-2-piperidin-1-ylphenyl)acetamide is sourced from PubChem (CID 3917226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).