3-(ethylsulfamoyl)-N-methyl-N-(pyridin-2-ylmethyl)benzamide

C16H19N3O3S — CID 55980508

IUPAC3-(ethylsulfamoyl)-N-methyl-N-(pyridin-2-ylmethyl)benzamide
SMILESCCNS(=O)(=O)c1cccc(C(=O)N(C)Cc2ccccn2)c1
InChIInChI=1S/C16H19N3O3S/c1-3-18-23(21,22)15-9-6-7-13(11-15)16(20)19(2)12-14-8-4-5-10-17-14/h4-11,18H,3,12H2,1-2H3
InChIKeyIMHDBINTMKOJHA-UHFFFAOYSA-N
MW333.41 g/mol
LogP1.65
Rot. Bonds6

About 3-(ethylsulfamoyl)-N-methyl-N-(pyridin-2-ylmethyl)benzamide

3-(ethylsulfamoyl)-N-methyl-N-(pyridin-2-ylmethyl)benzamide (PubChem CID 55980508) has the molecular formula C16H19N3O3S and a molecular weight of 333.41 g/mol. Its IUPAC name is 3-(ethylsulfamoyl)-N-methyl-N-(pyridin-2-ylmethyl)benzamide.

Molecular Properties

Compound Name3-(ethylsulfamoyl)-N-methyl-N-(pyridin-2-ylmethyl)benzamide
PubChem CID55980508
Molecular FormulaC16H19N3O3S
Molecular Weight333.41 g/mol
Exact Mass333.11
IUPAC Name3-(ethylsulfamoyl)-N-methyl-N-(pyridin-2-ylmethyl)benzamide
SMILESCCNS(=O)(=O)c1cccc(C(=O)N(C)Cc2ccccn2)c1
InChIInChI=1S/C16H19N3O3S/c1-3-18-23(21,22)15-9-6-7-13(11-15)16(20)19(2)12-14-8-4-5-10-17-14/h4-11,18H,3,12H2,1-2H3
InChIKeyIMHDBINTMKOJHA-UHFFFAOYSA-N
XLogP1.65
TPSA79.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.41
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-benzyl-N-methyl-3-(pyridin-2-ylmethylsulfamoyl)benzamide
CID 109064675
N-methyl-3-(prop-2-ynylsulfamoyl)-N-(2-pyridin-2-ylethyl)benzamide
CID 134008758
N-[(2,3-dimethoxyphenyl)methyl]-3-(ethylsulfamoyl)-N-methylbenzamide
CID 36544729
5-(ethylsulfamoyl)-N,2-dimethyl-N-(2-pyridin-2-ylethyl)benzamide
CID 134008752
N-benzyl-N-methyl-3-(pyridin-4-ylmethylsulfamoyl)benzamide
CID 109064677
N-methyl-N-(pyridin-2-ylmethyl)-3H-benzimidazole-5-carboxamide
CID 43582173
N-benzyl-N-butan-2-yl-3-(ethylsulfamoyl)benzamide
CID 56536496
4-fluoro-N,3-dimethyl-N-(pyridin-2-ylmethyl)benzamide
CID 63212311
3-hydroxy-4-iodo-N-methyl-N-(pyridin-2-ylmethyl)benzamide
CID 104627774
4-amino-N-methyl-N-(pyridin-2-ylmethyl)benzamide
CID 43564701
3-(ethylsulfamoyl)-N-propan-2-yl-N-(pyridin-3-ylmethyl)benzamide
CID 55818997
N-(2-ethylphenyl)-3-(pyridin-2-ylmethylsulfamoyl)benzamide
CID 109064805

Frequently Asked Questions

What is the IUPAC name of 3-(ethylsulfamoyl)-N-methyl-N-(pyridin-2-ylmethyl)benzamide?
The IUPAC name of 3-(ethylsulfamoyl)-N-methyl-N-(pyridin-2-ylmethyl)benzamide (CID 55980508) is 3-(ethylsulfamoyl)-N-methyl-N-(pyridin-2-ylmethyl)benzamide.
What is the SMILES notation for 3-(ethylsulfamoyl)-N-methyl-N-(pyridin-2-ylmethyl)benzamide?
The canonical SMILES for 3-(ethylsulfamoyl)-N-methyl-N-(pyridin-2-ylmethyl)benzamide is CCNS(=O)(=O)c1cccc(C(=O)N(C)Cc2ccccn2)c1.
What is the InChIKey of 3-(ethylsulfamoyl)-N-methyl-N-(pyridin-2-ylmethyl)benzamide?
The InChIKey is IMHDBINTMKOJHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O3S/c1-3-18-23(21,22)15-9-6-7-13(11-15)16(20)19(2)12-14-8-4-5-10-17-14/h4-11,18H,3,12H2,1-2H3.
What are the key properties of 3-(ethylsulfamoyl)-N-methyl-N-(pyridin-2-ylmethyl)benzamide?
3-(ethylsulfamoyl)-N-methyl-N-(pyridin-2-ylmethyl)benzamide has a molecular weight of 333.41 g/mol, XLogP of 1.65, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethylsulfamoyl)-N-methyl-N-(pyridin-2-ylmethyl)benzamide is sourced from PubChem (CID 55980508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).