2-[(4-methylphenyl)sulfonylamino]-N-(pyridin-2-ylmethyl)benzamide

C20H19N3O3S — CID 2973231

IUPAC2-[(4-methylphenyl)sulfonylamino]-N-(pyridin-2-ylmethyl)benzamide
SMILESCc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NCc2ccccn2)cc1
InChIInChI=1S/C20H19N3O3S/c1-15-9-11-17(12-10-15)27(25,26)23-19-8-3-2-7-18(19)20(24)22-14-16-6-4-5-13-21-16/h2-13,23H,14H2,1H3,(H,22,24)
InChIKeyHHAHHYMGHJTPDZ-UHFFFAOYSA-N
MW381.46 g/mol
LogP3.12
Rot. Bonds6

About 2-[(4-methylphenyl)sulfonylamino]-N-(pyridin-2-ylmethyl)benzamide

2-[(4-methylphenyl)sulfonylamino]-N-(pyridin-2-ylmethyl)benzamide (PubChem CID 2973231) has the molecular formula C20H19N3O3S and a molecular weight of 381.46 g/mol. Its IUPAC name is 2-[(4-methylphenyl)sulfonylamino]-N-(pyridin-2-ylmethyl)benzamide.

Molecular Properties

Compound Name2-[(4-methylphenyl)sulfonylamino]-N-(pyridin-2-ylmethyl)benzamide
PubChem CID2973231
Molecular FormulaC20H19N3O3S
Molecular Weight381.46 g/mol
Exact Mass381.11
IUPAC Name2-[(4-methylphenyl)sulfonylamino]-N-(pyridin-2-ylmethyl)benzamide
SMILESCc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NCc2ccccn2)cc1
InChIInChI=1S/C20H19N3O3S/c1-15-9-11-17(12-10-15)27(25,26)23-19-8-3-2-7-18(19)20(24)22-14-16-6-4-5-13-21-16/h2-13,23H,14H2,1H3,(H,22,24)
InChIKeyHHAHHYMGHJTPDZ-UHFFFAOYSA-N
XLogP3.12
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.46
LogP ≤ 53.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[(4-methylphenyl)sulfonylamino]-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

Related Compounds

N-[(4-methylphenyl)methyl]-2-[(4-methylphenyl)sulfonylamino]benzamide
CID 2979882
N-(furan-2-ylmethyl)-2-[(4-methylphenyl)sulfonylamino]benzamide
CID 1112090
2-acetamido-N-(pyridin-2-ylmethyl)benzamide
CID 783556
N-[(4-methylphenyl)methyl]-2-[(4-nitrophenyl)sulfonylamino]benzamide
CID 17319797
2-(ethylamino)-N-(pyridin-2-ylmethyl)benzamide
CID 62167465
N-[(2,5-diethylphenyl)methyl]-2-[(4-methylphenyl)sulfonylamino]benzamide
CID 100558623
4-methyl-N-(pyridin-2-ylmethyl)benzenesulfonamide
CID 731623
N-[(2-imidazol-1-ylphenyl)methyl]-2-[(4-methylphenyl)sulfonylamino]benzamide
CID 46771026
2-[(4-fluorophenyl)sulfonylamino]-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]benzamide
CID 46477862
N-(3-aminobutyl)-2-[(4-methylphenyl)sulfonylamino]benzamide
CID 119497804
5-(4-methylphenyl)-N-(pyridin-2-ylmethyl)-1H-pyrazole-4-carboxamide
CID 71824606
4-methyl-N-[2-[[(4-methylphenyl)sulfonylamino]carbamoyl]phenyl]benzenesulfonamide
CID 4711775

Frequently Asked Questions

What is the IUPAC name of 2-[(4-methylphenyl)sulfonylamino]-N-(pyridin-2-ylmethyl)benzamide?
The IUPAC name of 2-[(4-methylphenyl)sulfonylamino]-N-(pyridin-2-ylmethyl)benzamide (CID 2973231) is 2-[(4-methylphenyl)sulfonylamino]-N-(pyridin-2-ylmethyl)benzamide.
What is the SMILES notation for 2-[(4-methylphenyl)sulfonylamino]-N-(pyridin-2-ylmethyl)benzamide?
The canonical SMILES for 2-[(4-methylphenyl)sulfonylamino]-N-(pyridin-2-ylmethyl)benzamide is Cc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NCc2ccccn2)cc1.
What is the InChIKey of 2-[(4-methylphenyl)sulfonylamino]-N-(pyridin-2-ylmethyl)benzamide?
The InChIKey is HHAHHYMGHJTPDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O3S/c1-15-9-11-17(12-10-15)27(25,26)23-19-8-3-2-7-18(19)20(24)22-14-16-6-4-5-13-21-16/h2-13,23H,14H2,1H3,(H,22,24).
What are the key properties of 2-[(4-methylphenyl)sulfonylamino]-N-(pyridin-2-ylmethyl)benzamide?
2-[(4-methylphenyl)sulfonylamino]-N-(pyridin-2-ylmethyl)benzamide has a molecular weight of 381.46 g/mol, XLogP of 3.12, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-methylphenyl)sulfonylamino]-N-(pyridin-2-ylmethyl)benzamide is sourced from PubChem (CID 2973231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).