3-(benzenesulfonamido)-N-methyl-N-(pyridin-3-ylmethyl)benzamide

C20H19N3O3S — CID 86976169

IUPAC3-(benzenesulfonamido)-N-methyl-N-(pyridin-3-ylmethyl)benzamide
SMILESCN(Cc1cccnc1)C(=O)c1cccc(NS(=O)(=O)c2ccccc2)c1
InChIInChI=1S/C20H19N3O3S/c1-23(15-16-7-6-12-21-14-16)20(24)17-8-5-9-18(13-17)22-27(25,26)19-10-3-2-4-11-19/h2-14,22H,15H2,1H3
InChIKeyZALIFXNQGZUKMU-UHFFFAOYSA-N
MW381.46 g/mol
LogP3.15
Rot. Bonds6

About 3-(benzenesulfonamido)-N-methyl-N-(pyridin-3-ylmethyl)benzamide

3-(benzenesulfonamido)-N-methyl-N-(pyridin-3-ylmethyl)benzamide (PubChem CID 86976169) has the molecular formula C20H19N3O3S and a molecular weight of 381.46 g/mol. Its IUPAC name is 3-(benzenesulfonamido)-N-methyl-N-(pyridin-3-ylmethyl)benzamide.

Molecular Properties

Compound Name3-(benzenesulfonamido)-N-methyl-N-(pyridin-3-ylmethyl)benzamide
PubChem CID86976169
Molecular FormulaC20H19N3O3S
Molecular Weight381.46 g/mol
Exact Mass381.11
IUPAC Name3-(benzenesulfonamido)-N-methyl-N-(pyridin-3-ylmethyl)benzamide
SMILESCN(Cc1cccnc1)C(=O)c1cccc(NS(=O)(=O)c2ccccc2)c1
InChIInChI=1S/C20H19N3O3S/c1-23(15-16-7-6-12-21-14-16)20(24)17-8-5-9-18(13-17)22-27(25,26)19-10-3-2-4-11-19/h2-14,22H,15H2,1H3
InChIKeyZALIFXNQGZUKMU-UHFFFAOYSA-N
XLogP3.15
TPSA79.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.46
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(benzenesulfonamido)-N-[(3-chlorophenyl)methyl]-N-methylbenzamide
CID 24660209
3-(benzenesulfonamido)-N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]benzamide
CID 38745291
3-(benzenesulfonamido)-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)benzamide
CID 43968037
N-[3-[benzyl(methyl)carbamoyl]phenyl]pyridine-3-carboxamide
CID 26162903
N-methyl-4-[(2-methylphenyl)sulfamoyl]-N-(pyridin-3-ylmethyl)benzamide
CID 86976183
3-(benzenesulfonamido)-N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-N-methylbenzamide
CID 17447862
N-benzyl-N-methyl-3-(pyridin-4-ylmethylsulfamoyl)benzamide
CID 109064677
3-[(3-chlorophenyl)sulfamoyl]-N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]benzamide
CID 24504607
3-(benzenesulfonamido)-N,N-dipropylbenzamide
CID 30282516
3-(benzenesulfonamidomethyl)-N-methyl-N-pyridin-3-ylbenzamide
CID 50914019
N-[[3-(benzenesulfonamido)phenyl]methyl]-N-methylprop-2-enamide
CID 154760114
3-methylsulfonyl-N-phenyl-N-(pyridin-3-ylmethyl)benzamide
CID 110619955

Frequently Asked Questions

What is the IUPAC name of 3-(benzenesulfonamido)-N-methyl-N-(pyridin-3-ylmethyl)benzamide?
The IUPAC name of 3-(benzenesulfonamido)-N-methyl-N-(pyridin-3-ylmethyl)benzamide (CID 86976169) is 3-(benzenesulfonamido)-N-methyl-N-(pyridin-3-ylmethyl)benzamide.
What is the SMILES notation for 3-(benzenesulfonamido)-N-methyl-N-(pyridin-3-ylmethyl)benzamide?
The canonical SMILES for 3-(benzenesulfonamido)-N-methyl-N-(pyridin-3-ylmethyl)benzamide is CN(Cc1cccnc1)C(=O)c1cccc(NS(=O)(=O)c2ccccc2)c1.
What is the InChIKey of 3-(benzenesulfonamido)-N-methyl-N-(pyridin-3-ylmethyl)benzamide?
The InChIKey is ZALIFXNQGZUKMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O3S/c1-23(15-16-7-6-12-21-14-16)20(24)17-8-5-9-18(13-17)22-27(25,26)19-10-3-2-4-11-19/h2-14,22H,15H2,1H3.
What are the key properties of 3-(benzenesulfonamido)-N-methyl-N-(pyridin-3-ylmethyl)benzamide?
3-(benzenesulfonamido)-N-methyl-N-(pyridin-3-ylmethyl)benzamide has a molecular weight of 381.46 g/mol, XLogP of 3.15, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(benzenesulfonamido)-N-methyl-N-(pyridin-3-ylmethyl)benzamide is sourced from PubChem (CID 86976169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).