2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]-N-propan-2-ylbenzamide

C19H24N2O4S — CID 94619748

IUPAC2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]-N-propan-2-ylbenzamide
SMILESCOc1cc(C)c(S(=O)(=O)Nc2ccccc2C(=O)NC(C)C)cc1C
InChIInChI=1S/C19H24N2O4S/c1-12(2)20-19(22)15-8-6-7-9-16(15)21-26(23,24)18-11-13(3)17(25-5)10-14(18)4/h6-12,21H,1-5H3,(H,20,22)
InChIKeyDRWRRNWHYXJVTI-UHFFFAOYSA-N
MW376.48 g/mol
LogP3.25
Rot. Bonds6

About 2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]-N-propan-2-ylbenzamide

2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]-N-propan-2-ylbenzamide (PubChem CID 94619748) has the molecular formula C19H24N2O4S and a molecular weight of 376.48 g/mol. Its IUPAC name is 2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]-N-propan-2-ylbenzamide.

Molecular Properties

Compound Name2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]-N-propan-2-ylbenzamide
PubChem CID94619748
Molecular FormulaC19H24N2O4S
Molecular Weight376.48 g/mol
Exact Mass376.15
IUPAC Name2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]-N-propan-2-ylbenzamide
SMILESCOc1cc(C)c(S(=O)(=O)Nc2ccccc2C(=O)NC(C)C)cc1C
InChIInChI=1S/C19H24N2O4S/c1-12(2)20-19(22)15-8-6-7-9-16(15)21-26(23,24)18-11-13(3)17(25-5)10-14(18)4/h6-12,21H,1-5H3,(H,20,22)
InChIKeyDRWRRNWHYXJVTI-UHFFFAOYSA-N
XLogP3.25
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.48
LogP ≤ 53.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(4-methoxy-3-methylphenyl)sulfonylamino]-N-propan-2-ylbenzamide
CID 40607885
2-[(5-methoxy-2,4-dimethylphenyl)sulfonylamino]benzamide
CID 91824586
methyl 2-[(2-methoxy-4,5-dimethylphenyl)sulfonylamino]benzoate
CID 27242666
N-[2-(methanesulfonamido)phenyl]-4-methoxy-2,5-dimethylbenzenesulfonamide
CID 113093443
2-[(4-methoxy-2-methyl-5-propan-2-ylphenyl)sulfonylamino]benzamide
CID 91824621
N-(2-fluorophenyl)-4-methoxy-2,5-dimethylbenzenesulfonamide
CID 2236619
N-(2-bromophenyl)-4-methoxy-2,5-dimethylbenzenesulfonamide
CID 100729224
2-[(4-methoxy-2-methyl-5-propan-2-ylphenyl)sulfonylamino]-N-(3-methoxypropyl)benzamide
CID 100545095
2-[(5-bromo-2-methoxyphenyl)sulfonylamino]-N-(1-phenylethyl)benzamide
CID 133228042
2-[(2,5-dimethoxyphenyl)sulfonylamino]-N-[(1R)-1-phenylethyl]benzamide
CID 51557476
4-methoxy-2,5-dimethyl-N-propan-2-ylbenzamide
CID 110761568
2-[[2-[[4-(2,2-dimethylpropanoyloxy)-3-methylphenyl]sulfonylamino]benzoyl]amino]propanoic acid
CID 10204966

Frequently Asked Questions

What is the IUPAC name of 2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]-N-propan-2-ylbenzamide?
The IUPAC name of 2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]-N-propan-2-ylbenzamide (CID 94619748) is 2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]-N-propan-2-ylbenzamide.
What is the SMILES notation for 2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]-N-propan-2-ylbenzamide?
The canonical SMILES for 2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]-N-propan-2-ylbenzamide is COc1cc(C)c(S(=O)(=O)Nc2ccccc2C(=O)NC(C)C)cc1C.
What is the InChIKey of 2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]-N-propan-2-ylbenzamide?
The InChIKey is DRWRRNWHYXJVTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4S/c1-12(2)20-19(22)15-8-6-7-9-16(15)21-26(23,24)18-11-13(3)17(25-5)10-14(18)4/h6-12,21H,1-5H3,(H,20,22).
What are the key properties of 2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]-N-propan-2-ylbenzamide?
2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]-N-propan-2-ylbenzamide has a molecular weight of 376.48 g/mol, XLogP of 3.25, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]-N-propan-2-ylbenzamide is sourced from PubChem (CID 94619748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).