2-chloro-5-(dimethylsulfamoyl)-N-(2-piperidin-1-ylpropyl)benzamide

C17H26ClN3O3S — CID 110301674

IUPAC2-chloro-5-(dimethylsulfamoyl)-N-(2-piperidin-1-ylpropyl)benzamide
SMILESCC(CNC(=O)c1cc(S(=O)(=O)N(C)C)ccc1Cl)N1CCCCC1
InChIInChI=1S/C17H26ClN3O3S/c1-13(21-9-5-4-6-10-21)12-19-17(22)15-11-14(7-8-16(15)18)25(23,24)20(2)3/h7-8,11,13H,4-6,9-10,12H2,1-3H3,(H,19,22)
InChIKeyVIRZNXMZSBSXQR-UHFFFAOYSA-N
MW387.93 g/mol
LogP2.19
Rot. Bonds6

About 2-chloro-5-(dimethylsulfamoyl)-N-(2-piperidin-1-ylpropyl)benzamide

2-chloro-5-(dimethylsulfamoyl)-N-(2-piperidin-1-ylpropyl)benzamide (PubChem CID 110301674) has the molecular formula C17H26ClN3O3S and a molecular weight of 387.93 g/mol. Its IUPAC name is 2-chloro-5-(dimethylsulfamoyl)-N-(2-piperidin-1-ylpropyl)benzamide.

Molecular Properties

Compound Name2-chloro-5-(dimethylsulfamoyl)-N-(2-piperidin-1-ylpropyl)benzamide
PubChem CID110301674
Molecular FormulaC17H26ClN3O3S
Molecular Weight387.93 g/mol
Exact Mass387.14
IUPAC Name2-chloro-5-(dimethylsulfamoyl)-N-(2-piperidin-1-ylpropyl)benzamide
SMILESCC(CNC(=O)c1cc(S(=O)(=O)N(C)C)ccc1Cl)N1CCCCC1
InChIInChI=1S/C17H26ClN3O3S/c1-13(21-9-5-4-6-10-21)12-19-17(22)15-11-14(7-8-16(15)18)25(23,24)20(2)3/h7-8,11,13H,4-6,9-10,12H2,1-3H3,(H,19,22)
InChIKeyVIRZNXMZSBSXQR-UHFFFAOYSA-N
XLogP2.19
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.93
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloro-5-(dimethylsulfamoyl)-N-(4-methylpentyl)benzamide
CID 32612809
5-(dimethylsulfamoyl)-N-[2-(methylamino)propyl]-2-pyrrolidin-1-ylbenzamide;hydrochloride
CID 120833091
2-chloro-4-fluoro-N-(2-pyrrolidin-1-ylpropyl)benzamide
CID 47031094
5-chloro-2-fluoro-N-(2-pyrrolidin-1-ylpropyl)benzamide
CID 47031099
2-chloro-5-(dimethylsulfamoyl)-N-(3-morpholin-4-ylpropyl)benzamide
CID 8884146
N-(4-acetamidobutyl)-2-chloro-5-(dimethylsulfamoyl)benzamide
CID 110356795
4-chloro-2-fluoro-N-(2-pyrrolidin-1-ylpropyl)benzamide
CID 47031098
N-[2-(azepan-1-yl)ethyl]-2-chloro-5-(diethylsulfamoyl)benzamide
CID 46387530
N-[(2S)-2-(2-chlorophenyl)-2-pyrrolidin-1-ylethyl]-4-(dimethylsulfamoyl)benzamide
CID 26795013
3-(azetidine-1-carbonyl)-4-chloro-N,N-dimethylbenzenesulfonamide
CID 78802366
2-chloro-5-(dimethylsulfamoyl)benzoic acid
CID 2324784
2-chloro-5-[(4-fluorophenyl)sulfamoyl]-N-[2-(3-methylpiperidin-1-yl)propyl]benzamide
CID 55840001

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-(dimethylsulfamoyl)-N-(2-piperidin-1-ylpropyl)benzamide?
The IUPAC name of 2-chloro-5-(dimethylsulfamoyl)-N-(2-piperidin-1-ylpropyl)benzamide (CID 110301674) is 2-chloro-5-(dimethylsulfamoyl)-N-(2-piperidin-1-ylpropyl)benzamide.
What is the SMILES notation for 2-chloro-5-(dimethylsulfamoyl)-N-(2-piperidin-1-ylpropyl)benzamide?
The canonical SMILES for 2-chloro-5-(dimethylsulfamoyl)-N-(2-piperidin-1-ylpropyl)benzamide is CC(CNC(=O)c1cc(S(=O)(=O)N(C)C)ccc1Cl)N1CCCCC1.
What is the InChIKey of 2-chloro-5-(dimethylsulfamoyl)-N-(2-piperidin-1-ylpropyl)benzamide?
The InChIKey is VIRZNXMZSBSXQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26ClN3O3S/c1-13(21-9-5-4-6-10-21)12-19-17(22)15-11-14(7-8-16(15)18)25(23,24)20(2)3/h7-8,11,13H,4-6,9-10,12H2,1-3H3,(H,19,22).
What are the key properties of 2-chloro-5-(dimethylsulfamoyl)-N-(2-piperidin-1-ylpropyl)benzamide?
2-chloro-5-(dimethylsulfamoyl)-N-(2-piperidin-1-ylpropyl)benzamide has a molecular weight of 387.93 g/mol, XLogP of 2.19, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-(dimethylsulfamoyl)-N-(2-piperidin-1-ylpropyl)benzamide is sourced from PubChem (CID 110301674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).