2,3,5,6-tetramethyl-N-(2-morpholin-4-ylphenyl)benzenesulfonamide

C20H26N2O3S — CID 2078251

IUPAC2,3,5,6-tetramethyl-N-(2-morpholin-4-ylphenyl)benzenesulfonamide
SMILESCc1cc(C)c(C)c(S(=O)(=O)Nc2ccccc2N2CCOCC2)c1C
InChIInChI=1S/C20H26N2O3S/c1-14-13-15(2)17(4)20(16(14)3)26(23,24)21-18-7-5-6-8-19(18)22-9-11-25-12-10-22/h5-8,13,21H,9-12H2,1-4H3
InChIKeyBBPMSYQTFWJVQJ-UHFFFAOYSA-N
MW374.51 g/mol
LogP3.56
Rot. Bonds4

About 2,3,5,6-tetramethyl-N-(2-morpholin-4-ylphenyl)benzenesulfonamide

2,3,5,6-tetramethyl-N-(2-morpholin-4-ylphenyl)benzenesulfonamide (PubChem CID 2078251) has the molecular formula C20H26N2O3S and a molecular weight of 374.51 g/mol. Its IUPAC name is 2,3,5,6-tetramethyl-N-(2-morpholin-4-ylphenyl)benzenesulfonamide.

Molecular Properties

Compound Name2,3,5,6-tetramethyl-N-(2-morpholin-4-ylphenyl)benzenesulfonamide
PubChem CID2078251
Molecular FormulaC20H26N2O3S
Molecular Weight374.51 g/mol
Exact Mass374.17
IUPAC Name2,3,5,6-tetramethyl-N-(2-morpholin-4-ylphenyl)benzenesulfonamide
SMILESCc1cc(C)c(C)c(S(=O)(=O)Nc2ccccc2N2CCOCC2)c1C
InChIInChI=1S/C20H26N2O3S/c1-14-13-15(2)17(4)20(16(14)3)26(23,24)21-18-7-5-6-8-19(18)22-9-11-25-12-10-22/h5-8,13,21H,9-12H2,1-4H3
InChIKeyBBPMSYQTFWJVQJ-UHFFFAOYSA-N
XLogP3.56
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.51
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-methyl-N-(2-morpholinophenyl)benzenesulfonamide
CID 2813423
N-(2-morpholin-4-ylphenyl)-2-(trifluoromethyl)benzenesulfonamide
CID 4794707
2,4-dimethyl-N-[2-(morpholin-4-yl)-5-(trifluoromethyl)phenyl]benzene-1-sulfonamide
CID 2078255
N-(2-morpholin-4-ylphenyl)-1-(2,3,5,6-tetramethylphenyl)sulfonylpiperidine-4-carboxamide
CID 2094510
4-tert-butyl-N-(2-morpholin-4-ylphenyl)benzenesulfonamide
CID 3338291
5-tert-butyl-N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]-2-methylbenzenesulfonamide
CID 4009065
N-[5-(diethylsulfamoyl)-2-morpholin-4-ylphenyl]-3,4-dimethylbenzenesulfonamide
CID 4024925
3,4-dimethyl-N-(4-morpholin-4-ylphenyl)benzenesulfonamide
CID 7938968
3,4-Dimethyl-N-(2-morpholin-4-YL-5-trifluoromethyl-phenyl)-benzenesulfonamide
CID 2117079
2,4,6-Trimethyl-N-[4-(4-morpholinyl)phenyl]benzenesulfonamide
CID 1069413
N,N-diethyl-4-morpholin-4-yl-3-[(4-propan-2-ylphenyl)sulfonylamino]benzenesulfonamide
CID 4372604
N-(4-morpholin-4-ylphenyl)-4-propan-2-ylbenzenesulfonamide
CID 4460840

Frequently Asked Questions

What is the IUPAC name of 2,3,5,6-tetramethyl-N-(2-morpholin-4-ylphenyl)benzenesulfonamide?
The IUPAC name of 2,3,5,6-tetramethyl-N-(2-morpholin-4-ylphenyl)benzenesulfonamide (CID 2078251) is 2,3,5,6-tetramethyl-N-(2-morpholin-4-ylphenyl)benzenesulfonamide.
What is the SMILES notation for 2,3,5,6-tetramethyl-N-(2-morpholin-4-ylphenyl)benzenesulfonamide?
The canonical SMILES for 2,3,5,6-tetramethyl-N-(2-morpholin-4-ylphenyl)benzenesulfonamide is Cc1cc(C)c(C)c(S(=O)(=O)Nc2ccccc2N2CCOCC2)c1C.
What is the InChIKey of 2,3,5,6-tetramethyl-N-(2-morpholin-4-ylphenyl)benzenesulfonamide?
The InChIKey is BBPMSYQTFWJVQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O3S/c1-14-13-15(2)17(4)20(16(14)3)26(23,24)21-18-7-5-6-8-19(18)22-9-11-25-12-10-22/h5-8,13,21H,9-12H2,1-4H3.
What are the key properties of 2,3,5,6-tetramethyl-N-(2-morpholin-4-ylphenyl)benzenesulfonamide?
2,3,5,6-tetramethyl-N-(2-morpholin-4-ylphenyl)benzenesulfonamide has a molecular weight of 374.51 g/mol, XLogP of 3.56, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,5,6-tetramethyl-N-(2-morpholin-4-ylphenyl)benzenesulfonamide is sourced from PubChem (CID 2078251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).