N-(2,6-dimethylphenyl)-2-(2,4,6-trimethylphenyl)ethenesulfonamide

C19H23NO2S — CID 71835205

IUPACN-(2,6-dimethylphenyl)-2-(2,4,6-trimethylphenyl)ethenesulfonamide
SMILESCc1cc(C)c(C=CS(=O)(=O)Nc2c(C)cccc2C)c(C)c1
InChIInChI=1S/C19H23NO2S/c1-13-11-16(4)18(17(5)12-13)9-10-23(21,22)20-19-14(2)7-6-8-15(19)3/h6-12,20H,1-5H3
InChIKeyRZJPYCNDLFYFGH-UHFFFAOYSA-N
MW329.47 g/mol
LogP4.64
Rot. Bonds4

About N-(2,6-dimethylphenyl)-2-(2,4,6-trimethylphenyl)ethenesulfonamide

N-(2,6-dimethylphenyl)-2-(2,4,6-trimethylphenyl)ethenesulfonamide (PubChem CID 71835205) has the molecular formula C19H23NO2S and a molecular weight of 329.47 g/mol. Its IUPAC name is N-(2,6-dimethylphenyl)-2-(2,4,6-trimethylphenyl)ethenesulfonamide.

Molecular Properties

Compound NameN-(2,6-dimethylphenyl)-2-(2,4,6-trimethylphenyl)ethenesulfonamide
PubChem CID71835205
Molecular FormulaC19H23NO2S
Molecular Weight329.47 g/mol
Exact Mass329.14
IUPAC NameN-(2,6-dimethylphenyl)-2-(2,4,6-trimethylphenyl)ethenesulfonamide
SMILESCc1cc(C)c(C=CS(=O)(=O)Nc2c(C)cccc2C)c(C)c1
InChIInChI=1S/C19H23NO2S/c1-13-11-16(4)18(17(5)12-13)9-10-23(21,22)20-19-14(2)7-6-8-15(19)3/h6-12,20H,1-5H3
InChIKeyRZJPYCNDLFYFGH-UHFFFAOYSA-N
XLogP4.64
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.47
LogP ≤ 54.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-methylphenyl)-2-(2,4,6-trimethylphenyl)ethenesulfonamide
CID 71835207
(E)-N-(3-bromophenyl)-2-(2,4,6-trimethylphenyl)ethenesulfonamide
CID 90481104
(E)-N-pyridin-2-yl-2-(2,4,6-trimethylphenyl)ethenesulfonamide
CID 97465028
(E)-N-naphthalen-1-yl-2-(2,4,6-trimethylphenyl)ethenesulfonamide
CID 90481118
(E)-N-(4-fluorophenyl)-2-(2,4,6-trimethylphenyl)ethenesulfonamide
CID 90481095
(E)-N-(2-ethyl-6-methylphenyl)-2-phenylethenesulfonamide
CID 26952385
N-(5-chloro-2,4-dimethoxyphenyl)-2-(2,4,6-trimethylphenyl)ethenesulfonamide
CID 71835226
(E)-N-(2,6-difluorophenyl)-2-(4-methylphenyl)ethenesulfonamide
CID 60532924
N-(2,6-dimethylphenyl)sulfamoyl chloride
CID 84760590
N-(2,6-dimethylphenyl)-2,5-dimethylbenzenesulfonamide
CID 8504690
1-N,5-N-bis(2,4,6-trimethylphenyl)naphthalene-1,5-disulfonamide
CID 25043994
1,3,5-trimethyl-2-prop-1-enylbenzene
CID 54520603

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethylphenyl)-2-(2,4,6-trimethylphenyl)ethenesulfonamide?
The IUPAC name of N-(2,6-dimethylphenyl)-2-(2,4,6-trimethylphenyl)ethenesulfonamide (CID 71835205) is N-(2,6-dimethylphenyl)-2-(2,4,6-trimethylphenyl)ethenesulfonamide.
What is the SMILES notation for N-(2,6-dimethylphenyl)-2-(2,4,6-trimethylphenyl)ethenesulfonamide?
The canonical SMILES for N-(2,6-dimethylphenyl)-2-(2,4,6-trimethylphenyl)ethenesulfonamide is Cc1cc(C)c(C=CS(=O)(=O)Nc2c(C)cccc2C)c(C)c1.
What is the InChIKey of N-(2,6-dimethylphenyl)-2-(2,4,6-trimethylphenyl)ethenesulfonamide?
The InChIKey is RZJPYCNDLFYFGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2S/c1-13-11-16(4)18(17(5)12-13)9-10-23(21,22)20-19-14(2)7-6-8-15(19)3/h6-12,20H,1-5H3.
What are the key properties of N-(2,6-dimethylphenyl)-2-(2,4,6-trimethylphenyl)ethenesulfonamide?
N-(2,6-dimethylphenyl)-2-(2,4,6-trimethylphenyl)ethenesulfonamide has a molecular weight of 329.47 g/mol, XLogP of 4.64, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethylphenyl)-2-(2,4,6-trimethylphenyl)ethenesulfonamide is sourced from PubChem (CID 71835205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).