2-(4-chlorophenyl)sulfonyl-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride

C14H20Cl2N2O3S — CID 120576176

IUPAC2-(4-chlorophenyl)sulfonyl-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride
SMILESCC1NCCCC1NC(=O)CS(=O)(=O)c1ccc(Cl)cc1.Cl
InChIInChI=1S/C14H19ClN2O3S.ClH/c1-10-13(3-2-8-16-10)17-14(18)9-21(19,20)12-6-4-11(15)5-7-12;/h4-7,10,13,16H,2-3,8-9H2,1H3,(H,17,18);1H
InChIKeyZIBIZTLOGDIRBE-UHFFFAOYSA-N
MW367.30 g/mol
LogP1.79
Rot. Bonds4

About 2-(4-chlorophenyl)sulfonyl-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride

2-(4-chlorophenyl)sulfonyl-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride (PubChem CID 120576176) has the molecular formula C14H20Cl2N2O3S and a molecular weight of 367.30 g/mol. Its IUPAC name is 2-(4-chlorophenyl)sulfonyl-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-(4-chlorophenyl)sulfonyl-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride
PubChem CID120576176
Molecular FormulaC14H20Cl2N2O3S
Molecular Weight367.30 g/mol
Exact Mass366.06
IUPAC Name2-(4-chlorophenyl)sulfonyl-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride
SMILESCC1NCCCC1NC(=O)CS(=O)(=O)c1ccc(Cl)cc1.Cl
InChIInChI=1S/C14H19ClN2O3S.ClH/c1-10-13(3-2-8-16-10)17-14(18)9-21(19,20)12-6-4-11(15)5-7-12;/h4-7,10,13,16H,2-3,8-9H2,1H3,(H,17,18);1H
InChIKeyZIBIZTLOGDIRBE-UHFFFAOYSA-N
XLogP1.79
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.30
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(4-chlorophenyl)-N-(2-methylpiperidin-3-yl)propanamide
CID 120574232
3-acetamido-3-(4-chlorophenyl)-N-(2-methylpiperidin-3-yl)propanamide;hydrochloride
CID 120574869
4-ethylsulfonyl-N-(2-methylpiperidin-3-yl)benzamide
CID 120574136
N-(2-methylpiperidin-3-yl)-2-phenylacetamide;hydrochloride
CID 120574528
N-(2-methylpiperidin-3-yl)-2-propylsulfonylacetamide
CID 120577111
2-(2,5-dichlorophenoxy)-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride
CID 120577794
2-(2,4-dichlorophenoxy)-N-(2-methylpiperidin-3-yl)acetamide
CID 120577365
N-(2-methylpiperidin-3-yl)-2-pentylsulfonylacetamide;hydrochloride
CID 120577037
2-[(4-methylcyclohexyl)sulfamoyl]-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride
CID 120575817
2-[5-(4-chlorophenyl)tetrazol-2-yl]-N-(2-methylpiperidin-3-yl)acetamide
CID 120575453
N-(2-methylpiperidin-3-yl)-5-(4-methylsulfonylphenoxy)pentanamide;hydrochloride
CID 120575876
1-(4-chlorophenyl)-N-(2-methylpiperidin-3-yl)cyclopentane-1-carboxamide
CID 120573779

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)sulfonyl-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride?
The IUPAC name of 2-(4-chlorophenyl)sulfonyl-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride (CID 120576176) is 2-(4-chlorophenyl)sulfonyl-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride.
What is the SMILES notation for 2-(4-chlorophenyl)sulfonyl-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride?
The canonical SMILES for 2-(4-chlorophenyl)sulfonyl-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride is CC1NCCCC1NC(=O)CS(=O)(=O)c1ccc(Cl)cc1.Cl.
What is the InChIKey of 2-(4-chlorophenyl)sulfonyl-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride?
The InChIKey is ZIBIZTLOGDIRBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O3S.ClH/c1-10-13(3-2-8-16-10)17-14(18)9-21(19,20)12-6-4-11(15)5-7-12;/h4-7,10,13,16H,2-3,8-9H2,1H3,(H,17,18);1H.
What are the key properties of 2-(4-chlorophenyl)sulfonyl-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride?
2-(4-chlorophenyl)sulfonyl-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride has a molecular weight of 367.30 g/mol, XLogP of 1.79, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)sulfonyl-N-(2-methylpiperidin-3-yl)acetamide;hydrochloride is sourced from PubChem (CID 120576176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).