N-(2-piperidin-1-ylethyl)-4-sulfamoylbenzamide

C14H21N3O3S — CID 68595243

IUPACN-(2-piperidin-1-ylethyl)-4-sulfamoylbenzamide
SMILESNS(=O)(=O)c1ccc(C(=O)NCCN2CCCCC2)cc1
InChIInChI=1S/C14H21N3O3S/c15-21(19,20)13-6-4-12(5-7-13)14(18)16-8-11-17-9-2-1-3-10-17/h4-7H,1-3,8-11H2,(H,16,18)(H2,15,19,20)
InChIKeyACWIBMMJPSBAFH-UHFFFAOYSA-N
MW311.41 g/mol
LogP0.55
Rot. Bonds5

About N-(2-piperidin-1-ylethyl)-4-sulfamoylbenzamide

N-(2-piperidin-1-ylethyl)-4-sulfamoylbenzamide (PubChem CID 68595243) has the molecular formula C14H21N3O3S and a molecular weight of 311.41 g/mol. Its IUPAC name is N-(2-piperidin-1-ylethyl)-4-sulfamoylbenzamide.

Molecular Properties

Compound NameN-(2-piperidin-1-ylethyl)-4-sulfamoylbenzamide
PubChem CID68595243
Molecular FormulaC14H21N3O3S
Molecular Weight311.41 g/mol
Exact Mass311.13
IUPAC NameN-(2-piperidin-1-ylethyl)-4-sulfamoylbenzamide
SMILESNS(=O)(=O)c1ccc(C(=O)NCCN2CCCCC2)cc1
InChIInChI=1S/C14H21N3O3S/c15-21(19,20)13-6-4-12(5-7-13)14(18)16-8-11-17-9-2-1-3-10-17/h4-7H,1-3,8-11H2,(H,16,18)(H2,15,19,20)
InChIKeyACWIBMMJPSBAFH-UHFFFAOYSA-N
XLogP0.55
TPSA92.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.41
LogP ≤ 50.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-morpholin-4-ylethyl)-4-sulfamoylbenzamide
CID 25060315
4-(methylamino)-N-(2-piperidin-1-ylethyl)benzamide
CID 62173827
N-[2-(azepan-1-yl)ethyl]-4-[(2-methylphenyl)sulfamoyl]benzamide
CID 37295302
4-(3-piperidin-1-ylpropoxy)-N-[(4-sulfamoylphenyl)methyl]benzamide
CID 177234140
N-[2-(azepan-1-yl)ethyl]-4-[(4-methoxyphenyl)sulfamoyl]benzamide
CID 37297933
4-amino-N-[3-oxo-3-(2-piperidin-1-ylethylamino)propyl]benzamide
CID 166390762
N-[3-(azepan-1-yl)propyl]-2-bromo-5-sulfamoylbenzamide
CID 134057435
N-[3-(azepan-1-yl)propyl]-4-(tert-butylsulfamoyl)benzamide
CID 30942643
N-[3-(azepan-1-yl)propyl]-4-(cyclopropylsulfamoyl)benzamide
CID 30942685
3,4-dimethyl-N-(2-piperidin-1-ylethyl)benzamide
CID 25237097
3-hydroxy-4-iodo-N-(2-piperidin-1-ylethyl)benzamide
CID 104627715
3-bromo-4-methyl-N-(2-piperidin-1-ylethyl)benzamide
CID 79467099

Frequently Asked Questions

What is the IUPAC name of N-(2-piperidin-1-ylethyl)-4-sulfamoylbenzamide?
The IUPAC name of N-(2-piperidin-1-ylethyl)-4-sulfamoylbenzamide (CID 68595243) is N-(2-piperidin-1-ylethyl)-4-sulfamoylbenzamide.
What is the SMILES notation for N-(2-piperidin-1-ylethyl)-4-sulfamoylbenzamide?
The canonical SMILES for N-(2-piperidin-1-ylethyl)-4-sulfamoylbenzamide is NS(=O)(=O)c1ccc(C(=O)NCCN2CCCCC2)cc1.
What is the InChIKey of N-(2-piperidin-1-ylethyl)-4-sulfamoylbenzamide?
The InChIKey is ACWIBMMJPSBAFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O3S/c15-21(19,20)13-6-4-12(5-7-13)14(18)16-8-11-17-9-2-1-3-10-17/h4-7H,1-3,8-11H2,(H,16,18)(H2,15,19,20).
What are the key properties of N-(2-piperidin-1-ylethyl)-4-sulfamoylbenzamide?
N-(2-piperidin-1-ylethyl)-4-sulfamoylbenzamide has a molecular weight of 311.41 g/mol, XLogP of 0.55, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-piperidin-1-ylethyl)-4-sulfamoylbenzamide is sourced from PubChem (CID 68595243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).