1-(3-chlorophenyl)-N-[4-(ethylsulfamoyl)phenyl]piperidine-4-carboxamide

C20H24ClN3O3S — CID 17153132

IUPAC1-(3-chlorophenyl)-N-[4-(ethylsulfamoyl)phenyl]piperidine-4-carboxamide
SMILESCCNS(=O)(=O)c1ccc(NC(=O)C2CCN(c3cccc(Cl)c3)CC2)cc1
InChIInChI=1S/C20H24ClN3O3S/c1-2-22-28(26,27)19-8-6-17(7-9-19)23-20(25)15-10-12-24(13-11-15)18-5-3-4-16(21)14-18/h3-9,14-15,22H,2,10-13H2,1H3,(H,23,25)
InChIKeyWKERPERDYAFFQU-UHFFFAOYSA-N
MW421.95 g/mol
LogP3.49
Rot. Bonds6

About 1-(3-chlorophenyl)-N-[4-(ethylsulfamoyl)phenyl]piperidine-4-carboxamide

1-(3-chlorophenyl)-N-[4-(ethylsulfamoyl)phenyl]piperidine-4-carboxamide (PubChem CID 17153132) has the molecular formula C20H24ClN3O3S and a molecular weight of 421.95 g/mol. Its IUPAC name is 1-(3-chlorophenyl)-N-[4-(ethylsulfamoyl)phenyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(3-chlorophenyl)-N-[4-(ethylsulfamoyl)phenyl]piperidine-4-carboxamide
PubChem CID17153132
Molecular FormulaC20H24ClN3O3S
Molecular Weight421.95 g/mol
Exact Mass421.12
IUPAC Name1-(3-chlorophenyl)-N-[4-(ethylsulfamoyl)phenyl]piperidine-4-carboxamide
SMILESCCNS(=O)(=O)c1ccc(NC(=O)C2CCN(c3cccc(Cl)c3)CC2)cc1
InChIInChI=1S/C20H24ClN3O3S/c1-2-22-28(26,27)19-8-6-17(7-9-19)23-20(25)15-10-12-24(13-11-15)18-5-3-4-16(21)14-18/h3-9,14-15,22H,2,10-13H2,1H3,(H,23,25)
InChIKeyWKERPERDYAFFQU-UHFFFAOYSA-N
XLogP3.49
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500421.95
LogP ≤ 53.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(3-chlorophenyl)-N-(4-propan-2-ylphenyl)piperidine-4-carboxamide
CID 17153034
1-(3-chlorophenyl)-N-(4-methoxyphenyl)piperidine-4-carboxamide
CID 17152909
N-[4-(diethylsulfamoyl)phenyl]-1-phenylpiperidine-4-carboxamide
CID 17152471
N-[4-(ethylsulfamoyl)phenyl]-1-(4-fluorobenzoyl)piperidine-4-carboxamide
CID 17224011
1-(3-chlorophenyl)-N-(2-methylbutan-2-yl)piperidine-4-carboxamide
CID 17153110
1-(4-chlorobenzoyl)-N-[4-(propylsulfamoyl)phenyl]piperidine-4-carboxamide
CID 17119366
N-tert-butyl-1-(3-chlorophenyl)piperidine-4-carboxamide
CID 17152865
1-(2-fluorophenyl)-N-[4-(hexylsulfamoyl)phenyl]piperidine-4-carboxamide
CID 17152786
1-[4-(cyclopropanecarbonylamino)phenyl]-N-ethylpiperidine-4-carboxamide
CID 110668128
N-(3,5-dichlorophenyl)-1-phenylpiperidine-4-carboxamide
CID 17152302
N-(4-chlorophenyl)-1-ethylsulfonylpiperidine-4-carboxamide
CID 17027094
N-(4-chloro-2,5-dimethoxyphenyl)-1-(3-chlorophenyl)piperidine-4-carboxamide
CID 17153018

Frequently Asked Questions

What is the IUPAC name of 1-(3-chlorophenyl)-N-[4-(ethylsulfamoyl)phenyl]piperidine-4-carboxamide?
The IUPAC name of 1-(3-chlorophenyl)-N-[4-(ethylsulfamoyl)phenyl]piperidine-4-carboxamide (CID 17153132) is 1-(3-chlorophenyl)-N-[4-(ethylsulfamoyl)phenyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-(3-chlorophenyl)-N-[4-(ethylsulfamoyl)phenyl]piperidine-4-carboxamide?
The canonical SMILES for 1-(3-chlorophenyl)-N-[4-(ethylsulfamoyl)phenyl]piperidine-4-carboxamide is CCNS(=O)(=O)c1ccc(NC(=O)C2CCN(c3cccc(Cl)c3)CC2)cc1.
What is the InChIKey of 1-(3-chlorophenyl)-N-[4-(ethylsulfamoyl)phenyl]piperidine-4-carboxamide?
The InChIKey is WKERPERDYAFFQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24ClN3O3S/c1-2-22-28(26,27)19-8-6-17(7-9-19)23-20(25)15-10-12-24(13-11-15)18-5-3-4-16(21)14-18/h3-9,14-15,22H,2,10-13H2,1H3,(H,23,25).
What are the key properties of 1-(3-chlorophenyl)-N-[4-(ethylsulfamoyl)phenyl]piperidine-4-carboxamide?
1-(3-chlorophenyl)-N-[4-(ethylsulfamoyl)phenyl]piperidine-4-carboxamide has a molecular weight of 421.95 g/mol, XLogP of 3.49, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chlorophenyl)-N-[4-(ethylsulfamoyl)phenyl]piperidine-4-carboxamide is sourced from PubChem (CID 17153132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).