5-[(2-methoxyphenyl)-methylsulfamoyl]-2-methyl-N-(pyridin-2-ylmethyl)benzamide

C22H23N3O4S — CID 2512107

IUPAC5-[(2-methoxyphenyl)-methylsulfamoyl]-2-methyl-N-(pyridin-2-ylmethyl)benzamide
SMILESCOc1ccccc1N(C)S(=O)(=O)c1ccc(C)c(C(=O)NCc2ccccn2)c1
InChIInChI=1S/C22H23N3O4S/c1-16-11-12-18(14-19(16)22(26)24-15-17-8-6-7-13-23-17)30(27,28)25(2)20-9-4-5-10-21(20)29-3/h4-14H,15H2,1-3H3,(H,24,26)
InChIKeyRIEGFWCNFABDFK-UHFFFAOYSA-N
MW425.51 g/mol
LogP3.15
Rot. Bonds7

About 5-[(2-methoxyphenyl)-methylsulfamoyl]-2-methyl-N-(pyridin-2-ylmethyl)benzamide

5-[(2-methoxyphenyl)-methylsulfamoyl]-2-methyl-N-(pyridin-2-ylmethyl)benzamide (PubChem CID 2512107) has the molecular formula C22H23N3O4S and a molecular weight of 425.51 g/mol. Its IUPAC name is 5-[(2-methoxyphenyl)-methylsulfamoyl]-2-methyl-N-(pyridin-2-ylmethyl)benzamide.

Molecular Properties

Compound Name5-[(2-methoxyphenyl)-methylsulfamoyl]-2-methyl-N-(pyridin-2-ylmethyl)benzamide
PubChem CID2512107
Molecular FormulaC22H23N3O4S
Molecular Weight425.51 g/mol
Exact Mass425.14
IUPAC Name5-[(2-methoxyphenyl)-methylsulfamoyl]-2-methyl-N-(pyridin-2-ylmethyl)benzamide
SMILESCOc1ccccc1N(C)S(=O)(=O)c1ccc(C)c(C(=O)NCc2ccccn2)c1
InChIInChI=1S/C22H23N3O4S/c1-16-11-12-18(14-19(16)22(26)24-15-17-8-6-7-13-23-17)30(27,28)25(2)20-9-4-5-10-21(20)29-3/h4-14H,15H2,1-3H3,(H,24,26)
InChIKeyRIEGFWCNFABDFK-UHFFFAOYSA-N
XLogP3.15
TPSA88.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500425.51
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-[(2-methoxyphenyl)-methylsulfamoyl]-2-methyl-N-(pyridin-2-ylmethyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-[(2-methoxyphenyl)-methylsulfamoyl]-2-methyl-N-(pyridin-2-ylmethyl)benzamide?
The IUPAC name of 5-[(2-methoxyphenyl)-methylsulfamoyl]-2-methyl-N-(pyridin-2-ylmethyl)benzamide (CID 2512107) is 5-[(2-methoxyphenyl)-methylsulfamoyl]-2-methyl-N-(pyridin-2-ylmethyl)benzamide.
What is the SMILES notation for 5-[(2-methoxyphenyl)-methylsulfamoyl]-2-methyl-N-(pyridin-2-ylmethyl)benzamide?
The canonical SMILES for 5-[(2-methoxyphenyl)-methylsulfamoyl]-2-methyl-N-(pyridin-2-ylmethyl)benzamide is COc1ccccc1N(C)S(=O)(=O)c1ccc(C)c(C(=O)NCc2ccccn2)c1.
What is the InChIKey of 5-[(2-methoxyphenyl)-methylsulfamoyl]-2-methyl-N-(pyridin-2-ylmethyl)benzamide?
The InChIKey is RIEGFWCNFABDFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O4S/c1-16-11-12-18(14-19(16)22(26)24-15-17-8-6-7-13-23-17)30(27,28)25(2)20-9-4-5-10-21(20)29-3/h4-14H,15H2,1-3H3,(H,24,26).
What are the key properties of 5-[(2-methoxyphenyl)-methylsulfamoyl]-2-methyl-N-(pyridin-2-ylmethyl)benzamide?
5-[(2-methoxyphenyl)-methylsulfamoyl]-2-methyl-N-(pyridin-2-ylmethyl)benzamide has a molecular weight of 425.51 g/mol, XLogP of 3.15, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-methoxyphenyl)-methylsulfamoyl]-2-methyl-N-(pyridin-2-ylmethyl)benzamide is sourced from PubChem (CID 2512107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).