2-[benzenesulfonyl(benzyl)amino]benzamide

C20H18N2O3S — CID 1203978

IUPAC2-[benzenesulfonyl(benzyl)amino]benzamide
SMILESNC(=O)c1ccccc1N(Cc1ccccc1)S(=O)(=O)c1ccccc1
InChIInChI=1S/C20H18N2O3S/c21-20(23)18-13-7-8-14-19(18)22(15-16-9-3-1-4-10-16)26(24,25)17-11-5-2-6-12-17/h1-14H,15H2,(H2,21,23)
InChIKeyXNYYLXBTEDWNTQ-UHFFFAOYSA-N
MW366.44 g/mol
LogP3.18
Rot. Bonds6

About 2-[benzenesulfonyl(benzyl)amino]benzamide

2-[benzenesulfonyl(benzyl)amino]benzamide (PubChem CID 1203978) has the molecular formula C20H18N2O3S and a molecular weight of 366.44 g/mol. Its IUPAC name is 2-[benzenesulfonyl(benzyl)amino]benzamide.

Molecular Properties

Compound Name2-[benzenesulfonyl(benzyl)amino]benzamide
PubChem CID1203978
Molecular FormulaC20H18N2O3S
Molecular Weight366.44 g/mol
Exact Mass366.10
IUPAC Name2-[benzenesulfonyl(benzyl)amino]benzamide
SMILESNC(=O)c1ccccc1N(Cc1ccccc1)S(=O)(=O)c1ccccc1
InChIInChI=1S/C20H18N2O3S/c21-20(23)18-13-7-8-14-19(18)22(15-16-9-3-1-4-10-16)26(24,25)17-11-5-2-6-12-17/h1-14H,15H2,(H2,21,23)
InChIKeyXNYYLXBTEDWNTQ-UHFFFAOYSA-N
XLogP3.18
TPSA80.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.44
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[benzenesulfonyl(benzyl)amino]benzamide?
The IUPAC name of 2-[benzenesulfonyl(benzyl)amino]benzamide (CID 1203978) is 2-[benzenesulfonyl(benzyl)amino]benzamide.
What is the SMILES notation for 2-[benzenesulfonyl(benzyl)amino]benzamide?
The canonical SMILES for 2-[benzenesulfonyl(benzyl)amino]benzamide is NC(=O)c1ccccc1N(Cc1ccccc1)S(=O)(=O)c1ccccc1.
What is the InChIKey of 2-[benzenesulfonyl(benzyl)amino]benzamide?
The InChIKey is XNYYLXBTEDWNTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O3S/c21-20(23)18-13-7-8-14-19(18)22(15-16-9-3-1-4-10-16)26(24,25)17-11-5-2-6-12-17/h1-14H,15H2,(H2,21,23).
What are the key properties of 2-[benzenesulfonyl(benzyl)amino]benzamide?
2-[benzenesulfonyl(benzyl)amino]benzamide has a molecular weight of 366.44 g/mol, XLogP of 3.18, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[benzenesulfonyl(benzyl)amino]benzamide is sourced from PubChem (CID 1203978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).