N-[2-[1-(2-methylphenyl)ethenyl]phenyl]benzenesulfonamide

C21H19NO2S — CID 170558125

IUPACN-[2-[1-(2-methylphenyl)ethenyl]phenyl]benzenesulfonamide
SMILESC=C(c1ccccc1C)c1ccccc1NS(=O)(=O)c1ccccc1
InChIInChI=1S/C21H19NO2S/c1-16-10-6-7-13-19(16)17(2)20-14-8-9-15-21(20)22-25(23,24)18-11-4-3-5-12-18/h3-15,22H,2H2,1H3
InChIKeyYEXJSRGAUZPZCG-UHFFFAOYSA-N
MW349.46 g/mol
LogP4.86
Rot. Bonds5

About N-[2-[1-(2-methylphenyl)ethenyl]phenyl]benzenesulfonamide

N-[2-[1-(2-methylphenyl)ethenyl]phenyl]benzenesulfonamide (PubChem CID 170558125) has the molecular formula C21H19NO2S and a molecular weight of 349.46 g/mol. Its IUPAC name is N-[2-[1-(2-methylphenyl)ethenyl]phenyl]benzenesulfonamide.

Molecular Properties

Compound NameN-[2-[1-(2-methylphenyl)ethenyl]phenyl]benzenesulfonamide
PubChem CID170558125
Molecular FormulaC21H19NO2S
Molecular Weight349.46 g/mol
Exact Mass349.11
IUPAC NameN-[2-[1-(2-methylphenyl)ethenyl]phenyl]benzenesulfonamide
SMILESC=C(c1ccccc1C)c1ccccc1NS(=O)(=O)c1ccccc1
InChIInChI=1S/C21H19NO2S/c1-16-10-6-7-13-19(16)17(2)20-14-8-9-15-21(20)22-25(23,24)18-11-4-3-5-12-18/h3-15,22H,2H2,1H3
InChIKeyYEXJSRGAUZPZCG-UHFFFAOYSA-N
XLogP4.86
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.46
LogP ≤ 54.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-[1-(3-fluorophenyl)ethenyl]phenyl]-4-methylbenzenesulfonamide
CID 175305884
4-methyl-N-[5-methyl-2-(1-phenylethenyl)phenyl]benzenesulfonamide
CID 175305873
2-(benzenesulfonamido)-N-(5-chloro-2-methylphenyl)benzamide
CID 2977231
2-(benzenesulfonamido)-N-(3-methoxypropyl)benzamide
CID 2967457
2-[(4-carboxyphenyl)sulfonylamino]benzoic acid
CID 763907
phenyl 2-[(4-methylphenyl)sulfonylamino]benzoate
CID 154135516
2-[(4-chloro-3-methylphenyl)sulfonylamino]benzoic acid
CID 962498
2-(benzenesulfonamido)-N-benzylbenzamide
CID 1320833
2-[(4-acetamidophenyl)sulfonylamino]benzoic acid
CID 3863821
N-(2-acetylphenyl)-3-methylbenzenesulfonamide
CID 24694730
2-methyl-N-[2-[(4-methylphenyl)sulfonylamino]phenyl]prop-2-enamide
CID 18668318
methyl 2-[(4-iodophenyl)sulfonylamino]benzoate
CID 43423372

Frequently Asked Questions

What is the IUPAC name of N-[2-[1-(2-methylphenyl)ethenyl]phenyl]benzenesulfonamide?
The IUPAC name of N-[2-[1-(2-methylphenyl)ethenyl]phenyl]benzenesulfonamide (CID 170558125) is N-[2-[1-(2-methylphenyl)ethenyl]phenyl]benzenesulfonamide.
What is the SMILES notation for N-[2-[1-(2-methylphenyl)ethenyl]phenyl]benzenesulfonamide?
The canonical SMILES for N-[2-[1-(2-methylphenyl)ethenyl]phenyl]benzenesulfonamide is C=C(c1ccccc1C)c1ccccc1NS(=O)(=O)c1ccccc1.
What is the InChIKey of N-[2-[1-(2-methylphenyl)ethenyl]phenyl]benzenesulfonamide?
The InChIKey is YEXJSRGAUZPZCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19NO2S/c1-16-10-6-7-13-19(16)17(2)20-14-8-9-15-21(20)22-25(23,24)18-11-4-3-5-12-18/h3-15,22H,2H2,1H3.
What are the key properties of N-[2-[1-(2-methylphenyl)ethenyl]phenyl]benzenesulfonamide?
N-[2-[1-(2-methylphenyl)ethenyl]phenyl]benzenesulfonamide has a molecular weight of 349.46 g/mol, XLogP of 4.86, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[1-(2-methylphenyl)ethenyl]phenyl]benzenesulfonamide is sourced from PubChem (CID 170558125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).