1-[3-(ethylsulfamoyl)benzoyl]-N-methylpiperidine-4-carboxamide

C16H23N3O4S — CID 43064085

IUPAC1-[3-(ethylsulfamoyl)benzoyl]-N-methylpiperidine-4-carboxamide
SMILESCCNS(=O)(=O)c1cccc(C(=O)N2CCC(C(=O)NC)CC2)c1
InChIInChI=1S/C16H23N3O4S/c1-3-18-24(22,23)14-6-4-5-13(11-14)16(21)19-9-7-12(8-10-19)15(20)17-2/h4-6,11-12,18H,3,7-10H2,1-2H3,(H,17,20)
InChIKeySBKKEGDAMVXFLU-UHFFFAOYSA-N
MW353.44 g/mol
LogP0.58
Rot. Bonds5

About 1-[3-(ethylsulfamoyl)benzoyl]-N-methylpiperidine-4-carboxamide

1-[3-(ethylsulfamoyl)benzoyl]-N-methylpiperidine-4-carboxamide (PubChem CID 43064085) has the molecular formula C16H23N3O4S and a molecular weight of 353.44 g/mol. Its IUPAC name is 1-[3-(ethylsulfamoyl)benzoyl]-N-methylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-[3-(ethylsulfamoyl)benzoyl]-N-methylpiperidine-4-carboxamide
PubChem CID43064085
Molecular FormulaC16H23N3O4S
Molecular Weight353.44 g/mol
Exact Mass353.14
IUPAC Name1-[3-(ethylsulfamoyl)benzoyl]-N-methylpiperidine-4-carboxamide
SMILESCCNS(=O)(=O)c1cccc(C(=O)N2CCC(C(=O)NC)CC2)c1
InChIInChI=1S/C16H23N3O4S/c1-3-18-24(22,23)14-6-4-5-13(11-14)16(21)19-9-7-12(8-10-19)15(20)17-2/h4-6,11-12,18H,3,7-10H2,1-2H3,(H,17,20)
InChIKeySBKKEGDAMVXFLU-UHFFFAOYSA-N
XLogP0.58
TPSA95.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.44
LogP ≤ 50.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-[3-(ethylsulfamoyl)benzoyl]-N-methylpiperidine-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

Related Compounds

1-[3-(benzenesulfonamido)benzoyl]-N-methylpiperidine-4-carboxamide
CID 20974043
N-ethyl-3-(3-methylpiperidine-1-carbonyl)benzenesulfonamide
CID 46798331
3-[4-(methylcarbamoyl)piperidine-1-carbonyl]benzoic acid
CID 61440069
1-[3-(methylsulfamoyl)benzoyl]piperidine-4-carboxamide
CID 94786854
N-ethyl-3-[(2S)-2-methylpiperidine-1-carbonyl]benzenesulfonamide
CID 93232744
N-(cyclopropylmethyl)-3-[4-(methylamino)piperidine-1-carbonyl]benzenesulfonamide
CID 119563230
N-butyl-3-(pyrrolidine-1-carbonyl)benzenesulfonamide
CID 17226649
N-methyl-1-[3-[(2,4,6-trimethylphenyl)sulfonylamino]benzoyl]piperidine-4-carboxamide
CID 20974051
3-(azepane-1-carbonyl)-N-butylbenzenesulfonamide
CID 17226694
3-(4-aminopiperidine-1-carbonyl)-N-(cyclopropylmethyl)benzenesulfonamide
CID 119376148
3-(4-methylpiperidine-1-carbonyl)-N-prop-2-enylbenzenesulfonamide
CID 46652326
3-[4-[bis(4-fluorophenyl)methyl]piperazine-1-carbonyl]-N-ethylbenzenesulfonamide
CID 29218312

Frequently Asked Questions

What is the IUPAC name of 1-[3-(ethylsulfamoyl)benzoyl]-N-methylpiperidine-4-carboxamide?
The IUPAC name of 1-[3-(ethylsulfamoyl)benzoyl]-N-methylpiperidine-4-carboxamide (CID 43064085) is 1-[3-(ethylsulfamoyl)benzoyl]-N-methylpiperidine-4-carboxamide.
What is the SMILES notation for 1-[3-(ethylsulfamoyl)benzoyl]-N-methylpiperidine-4-carboxamide?
The canonical SMILES for 1-[3-(ethylsulfamoyl)benzoyl]-N-methylpiperidine-4-carboxamide is CCNS(=O)(=O)c1cccc(C(=O)N2CCC(C(=O)NC)CC2)c1.
What is the InChIKey of 1-[3-(ethylsulfamoyl)benzoyl]-N-methylpiperidine-4-carboxamide?
The InChIKey is SBKKEGDAMVXFLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O4S/c1-3-18-24(22,23)14-6-4-5-13(11-14)16(21)19-9-7-12(8-10-19)15(20)17-2/h4-6,11-12,18H,3,7-10H2,1-2H3,(H,17,20).
What are the key properties of 1-[3-(ethylsulfamoyl)benzoyl]-N-methylpiperidine-4-carboxamide?
1-[3-(ethylsulfamoyl)benzoyl]-N-methylpiperidine-4-carboxamide has a molecular weight of 353.44 g/mol, XLogP of 0.58, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(ethylsulfamoyl)benzoyl]-N-methylpiperidine-4-carboxamide is sourced from PubChem (CID 43064085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).