2-methoxy-5-[(3-methylphenyl)methylsulfamoyl]-N-propan-2-ylbenzamide

C19H24N2O4S — CID 53283069

IUPAC2-methoxy-5-[(3-methylphenyl)methylsulfamoyl]-N-propan-2-ylbenzamide
SMILESCOc1ccc(S(=O)(=O)NCc2cccc(C)c2)cc1C(=O)NC(C)C
InChIInChI=1S/C19H24N2O4S/c1-13(2)21-19(22)17-11-16(8-9-18(17)25-4)26(23,24)20-12-15-7-5-6-14(3)10-15/h5-11,13,20H,12H2,1-4H3,(H,21,22)
InChIKeyOFSRRJDSCGQTTO-UHFFFAOYSA-N
MW376.48 g/mol
LogP2.62
Rot. Bonds7

About 2-methoxy-5-[(3-methylphenyl)methylsulfamoyl]-N-propan-2-ylbenzamide

2-methoxy-5-[(3-methylphenyl)methylsulfamoyl]-N-propan-2-ylbenzamide (PubChem CID 53283069) has the molecular formula C19H24N2O4S and a molecular weight of 376.48 g/mol. Its IUPAC name is 2-methoxy-5-[(3-methylphenyl)methylsulfamoyl]-N-propan-2-ylbenzamide.

Molecular Properties

Compound Name2-methoxy-5-[(3-methylphenyl)methylsulfamoyl]-N-propan-2-ylbenzamide
PubChem CID53283069
Molecular FormulaC19H24N2O4S
Molecular Weight376.48 g/mol
Exact Mass376.15
IUPAC Name2-methoxy-5-[(3-methylphenyl)methylsulfamoyl]-N-propan-2-ylbenzamide
SMILESCOc1ccc(S(=O)(=O)NCc2cccc(C)c2)cc1C(=O)NC(C)C
InChIInChI=1S/C19H24N2O4S/c1-13(2)21-19(22)17-11-16(8-9-18(17)25-4)26(23,24)20-12-15-7-5-6-14(3)10-15/h5-11,13,20H,12H2,1-4H3,(H,21,22)
InChIKeyOFSRRJDSCGQTTO-UHFFFAOYSA-N
XLogP2.62
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.48
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-methoxy-N-methyl-5-[(3-methylphenyl)methylsulfamoyl]benzamide
CID 53282747
5-(benzylsulfamoyl)-2-methoxy-N-methylbenzamide
CID 6471587
4-amino-3-methoxy-N-[(3-methylphenyl)methyl]benzenesulfonamide
CID 81440806
2-methoxy-5-[[(1R)-1-(4-methylphenyl)ethyl]sulfamoyl]-N-propan-2-ylbenzamide
CID 28572520
N-butan-2-yl-4-[(3-methylphenyl)methylsulfamoyl]benzamide
CID 109059006
3,4-diethoxy-N-[(3-methylphenyl)methyl]benzenesulfonamide
CID 30788428
5-[(3-carbamoylphenyl)sulfamoyl]-2-methoxy-N-propan-2-ylbenzamide
CID 53283048
5-amino-2-methoxy-N-[(3-methylphenyl)methyl]benzamide
CID 61103300
N-[(3-aminophenyl)methyl]-4-methoxy-3-methylbenzenesulfonamide
CID 43593541
5-[(4-fluorophenyl)methylsulfamoyl]-2-methoxy-N-methylbenzamide
CID 46763335
2-methoxy-N-propan-2-yl-5-[1-(2,4,5-trimethylphenyl)ethylsulfamoyl]benzamide
CID 133220057
5-(benzylsulfamoyl)-N-[2-(2-methoxy-5-methylanilino)-2-oxoethyl]-2-methylbenzamide
CID 46550879

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-5-[(3-methylphenyl)methylsulfamoyl]-N-propan-2-ylbenzamide?
The IUPAC name of 2-methoxy-5-[(3-methylphenyl)methylsulfamoyl]-N-propan-2-ylbenzamide (CID 53283069) is 2-methoxy-5-[(3-methylphenyl)methylsulfamoyl]-N-propan-2-ylbenzamide.
What is the SMILES notation for 2-methoxy-5-[(3-methylphenyl)methylsulfamoyl]-N-propan-2-ylbenzamide?
The canonical SMILES for 2-methoxy-5-[(3-methylphenyl)methylsulfamoyl]-N-propan-2-ylbenzamide is COc1ccc(S(=O)(=O)NCc2cccc(C)c2)cc1C(=O)NC(C)C.
What is the InChIKey of 2-methoxy-5-[(3-methylphenyl)methylsulfamoyl]-N-propan-2-ylbenzamide?
The InChIKey is OFSRRJDSCGQTTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4S/c1-13(2)21-19(22)17-11-16(8-9-18(17)25-4)26(23,24)20-12-15-7-5-6-14(3)10-15/h5-11,13,20H,12H2,1-4H3,(H,21,22).
What are the key properties of 2-methoxy-5-[(3-methylphenyl)methylsulfamoyl]-N-propan-2-ylbenzamide?
2-methoxy-5-[(3-methylphenyl)methylsulfamoyl]-N-propan-2-ylbenzamide has a molecular weight of 376.48 g/mol, XLogP of 2.62, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-5-[(3-methylphenyl)methylsulfamoyl]-N-propan-2-ylbenzamide is sourced from PubChem (CID 53283069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).