1-(dimethylsulfamoyl)-N-(4-ethylphenyl)piperidine-4-carboxamide

C16H25N3O3S — CID 41454669

IUPAC1-(dimethylsulfamoyl)-N-(4-ethylphenyl)piperidine-4-carboxamide
SMILESCCc1ccc(NC(=O)C2CCN(S(=O)(=O)N(C)C)CC2)cc1
InChIInChI=1S/C16H25N3O3S/c1-4-13-5-7-15(8-6-13)17-16(20)14-9-11-19(12-10-14)23(21,22)18(2)3/h5-8,14H,4,9-12H2,1-3H3,(H,17,20)
InChIKeyUGPQTDTVZRITEI-UHFFFAOYSA-N
MW339.46 g/mol
LogP1.71
Rot. Bonds5

About 1-(dimethylsulfamoyl)-N-(4-ethylphenyl)piperidine-4-carboxamide

1-(dimethylsulfamoyl)-N-(4-ethylphenyl)piperidine-4-carboxamide (PubChem CID 41454669) has the molecular formula C16H25N3O3S and a molecular weight of 339.46 g/mol. Its IUPAC name is 1-(dimethylsulfamoyl)-N-(4-ethylphenyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(dimethylsulfamoyl)-N-(4-ethylphenyl)piperidine-4-carboxamide
PubChem CID41454669
Molecular FormulaC16H25N3O3S
Molecular Weight339.46 g/mol
Exact Mass339.16
IUPAC Name1-(dimethylsulfamoyl)-N-(4-ethylphenyl)piperidine-4-carboxamide
SMILESCCc1ccc(NC(=O)C2CCN(S(=O)(=O)N(C)C)CC2)cc1
InChIInChI=1S/C16H25N3O3S/c1-4-13-5-7-15(8-6-13)17-16(20)14-9-11-19(12-10-14)23(21,22)18(2)3/h5-8,14H,4,9-12H2,1-3H3,(H,17,20)
InChIKeyUGPQTDTVZRITEI-UHFFFAOYSA-N
XLogP1.71
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.46
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(dimethylsulfamoyl)-N-(4-ethylphenyl)piperidine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(dimethylsulfamoyl)-N-(4-ethylphenyl)piperidine-4-carboxamide?
The IUPAC name of 1-(dimethylsulfamoyl)-N-(4-ethylphenyl)piperidine-4-carboxamide (CID 41454669) is 1-(dimethylsulfamoyl)-N-(4-ethylphenyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(dimethylsulfamoyl)-N-(4-ethylphenyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(dimethylsulfamoyl)-N-(4-ethylphenyl)piperidine-4-carboxamide is CCc1ccc(NC(=O)C2CCN(S(=O)(=O)N(C)C)CC2)cc1.
What is the InChIKey of 1-(dimethylsulfamoyl)-N-(4-ethylphenyl)piperidine-4-carboxamide?
The InChIKey is UGPQTDTVZRITEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O3S/c1-4-13-5-7-15(8-6-13)17-16(20)14-9-11-19(12-10-14)23(21,22)18(2)3/h5-8,14H,4,9-12H2,1-3H3,(H,17,20).
What are the key properties of 1-(dimethylsulfamoyl)-N-(4-ethylphenyl)piperidine-4-carboxamide?
1-(dimethylsulfamoyl)-N-(4-ethylphenyl)piperidine-4-carboxamide has a molecular weight of 339.46 g/mol, XLogP of 1.71, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(dimethylsulfamoyl)-N-(4-ethylphenyl)piperidine-4-carboxamide is sourced from PubChem (CID 41454669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).