N-benzyl-N-ethyl-2-(pyridin-3-ylsulfamoyl)benzamide

C21H21N3O3S — CID 58924072

IUPACN-benzyl-N-ethyl-2-(pyridin-3-ylsulfamoyl)benzamide
SMILESCCN(Cc1ccccc1)C(=O)c1ccccc1S(=O)(=O)Nc1cccnc1
InChIInChI=1S/C21H21N3O3S/c1-2-24(16-17-9-4-3-5-10-17)21(25)19-12-6-7-13-20(19)28(26,27)23-18-11-8-14-22-15-18/h3-15,23H,2,16H2,1H3
InChIKeyJHWGAHLPJDDMBN-UHFFFAOYSA-N
MW395.48 g/mol
LogP3.54
Rot. Bonds7

About N-benzyl-N-ethyl-2-(pyridin-3-ylsulfamoyl)benzamide

N-benzyl-N-ethyl-2-(pyridin-3-ylsulfamoyl)benzamide (PubChem CID 58924072) has the molecular formula C21H21N3O3S and a molecular weight of 395.48 g/mol. Its IUPAC name is N-benzyl-N-ethyl-2-(pyridin-3-ylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-benzyl-N-ethyl-2-(pyridin-3-ylsulfamoyl)benzamide
PubChem CID58924072
Molecular FormulaC21H21N3O3S
Molecular Weight395.48 g/mol
Exact Mass395.13
IUPAC NameN-benzyl-N-ethyl-2-(pyridin-3-ylsulfamoyl)benzamide
SMILESCCN(Cc1ccccc1)C(=O)c1ccccc1S(=O)(=O)Nc1cccnc1
InChIInChI=1S/C21H21N3O3S/c1-2-24(16-17-9-4-3-5-10-17)21(25)19-12-6-7-13-20(19)28(26,27)23-18-11-8-14-22-15-18/h3-15,23H,2,16H2,1H3
InChIKeyJHWGAHLPJDDMBN-UHFFFAOYSA-N
XLogP3.54
TPSA79.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.48
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[4-[(dimethylamino)methyl]phenyl]methyl]-2-(pyridin-3-ylsulfamoyl)benzamide
CID 58924259
2-methyl-3-(pyridin-3-ylsulfamoyl)benzoic acid
CID 63742304
N-benzyl-N-ethylpyridine-3-carboxamide;hydrochloride
CID 110755487
N-[(4-methoxyphenyl)methyl]-2-(pyridin-3-ylsulfamoyl)benzamide
CID 58924237
N-benzyl-N-(pyridin-3-ylmethyl)-2-(quinolin-8-ylsulfonylamino)benzamide
CID 12020675
N-benzyl-N-ethylisoquinoline-8-carboxamide
CID 110851851
N-[(3,4-difluorophenyl)methyl]-2-(pyridin-3-ylsulfamoyl)benzamide
CID 58924303
N-benzyl-N-ethyl-4-(pyridin-3-ylmethylamino)pyridine-2-carboxamide
CID 109212489
1-benzyl-1-[2-(diethylamino)ethyl]-3-pyridin-3-ylurea
CID 60591438
2-[(2S,6R)-2,6-dimethylmorpholine-4-carbonyl]-N-pyridin-3-ylbenzenesulfonamide
CID 58924251
2-anilino-N-ethyl-N-(pyridin-4-ylmethyl)acetamide
CID 60962477
N-benzyl-N-ethyl-3-pyridin-3-ylbutanamide
CID 110648244

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-ethyl-2-(pyridin-3-ylsulfamoyl)benzamide?
The IUPAC name of N-benzyl-N-ethyl-2-(pyridin-3-ylsulfamoyl)benzamide (CID 58924072) is N-benzyl-N-ethyl-2-(pyridin-3-ylsulfamoyl)benzamide.
What is the SMILES notation for N-benzyl-N-ethyl-2-(pyridin-3-ylsulfamoyl)benzamide?
The canonical SMILES for N-benzyl-N-ethyl-2-(pyridin-3-ylsulfamoyl)benzamide is CCN(Cc1ccccc1)C(=O)c1ccccc1S(=O)(=O)Nc1cccnc1.
What is the InChIKey of N-benzyl-N-ethyl-2-(pyridin-3-ylsulfamoyl)benzamide?
The InChIKey is JHWGAHLPJDDMBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N3O3S/c1-2-24(16-17-9-4-3-5-10-17)21(25)19-12-6-7-13-20(19)28(26,27)23-18-11-8-14-22-15-18/h3-15,23H,2,16H2,1H3.
What are the key properties of N-benzyl-N-ethyl-2-(pyridin-3-ylsulfamoyl)benzamide?
N-benzyl-N-ethyl-2-(pyridin-3-ylsulfamoyl)benzamide has a molecular weight of 395.48 g/mol, XLogP of 3.54, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-ethyl-2-(pyridin-3-ylsulfamoyl)benzamide is sourced from PubChem (CID 58924072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).