4-[[(4-methoxyphenyl)sulfonylamino]methyl]-N,N-bis(2-methylpropyl)benzamide

C23H32N2O4S — CID 20854207

IUPAC4-[[(4-methoxyphenyl)sulfonylamino]methyl]-N,N-bis(2-methylpropyl)benzamide
SMILESCOc1ccc(S(=O)(=O)NCc2ccc(C(=O)N(CC(C)C)CC(C)C)cc2)cc1
InChIInChI=1S/C23H32N2O4S/c1-17(2)15-25(16-18(3)4)23(26)20-8-6-19(7-9-20)14-24-30(27,28)22-12-10-21(29-5)11-13-22/h6-13,17-18,24H,14-16H2,1-5H3
InChIKeyGZZLHMLVWAUOQN-UHFFFAOYSA-N
MW432.59 g/mol
LogP3.93
Rot. Bonds10

About 4-[[(4-methoxyphenyl)sulfonylamino]methyl]-N,N-bis(2-methylpropyl)benzamide

4-[[(4-methoxyphenyl)sulfonylamino]methyl]-N,N-bis(2-methylpropyl)benzamide (PubChem CID 20854207) has the molecular formula C23H32N2O4S and a molecular weight of 432.59 g/mol. Its IUPAC name is 4-[[(4-methoxyphenyl)sulfonylamino]methyl]-N,N-bis(2-methylpropyl)benzamide.

Molecular Properties

Compound Name4-[[(4-methoxyphenyl)sulfonylamino]methyl]-N,N-bis(2-methylpropyl)benzamide
PubChem CID20854207
Molecular FormulaC23H32N2O4S
Molecular Weight432.59 g/mol
Exact Mass432.21
IUPAC Name4-[[(4-methoxyphenyl)sulfonylamino]methyl]-N,N-bis(2-methylpropyl)benzamide
SMILESCOc1ccc(S(=O)(=O)NCc2ccc(C(=O)N(CC(C)C)CC(C)C)cc2)cc1
InChIInChI=1S/C23H32N2O4S/c1-17(2)15-25(16-18(3)4)23(26)20-8-6-19(7-9-20)14-24-30(27,28)22-12-10-21(29-5)11-13-22/h6-13,17-18,24H,14-16H2,1-5H3
InChIKeyGZZLHMLVWAUOQN-UHFFFAOYSA-N
XLogP3.93
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.59
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(4-methoxyphenyl)methylsulfamoyl]-N-(3-methylbutyl)benzamide
CID 109060824
methyl 4-[(4-methoxyphenyl)methylsulfamoyl]benzoate
CID 26527056
4-[(4-methoxyphenyl)methylsulfamoyl]benzamide
CID 27186990
4-[[(4-methoxyphenyl)sulfonylamino]methyl]-N-(3-propan-2-yloxypropyl)benzamide
CID 20854193
N-[(4-fluorophenyl)methyl]-4-[[(4-methoxyphenyl)sulfonylamino]methyl]benzamide
CID 3311699
4-[[(4-bromophenyl)sulfonylamino]methyl]-N-[(4-methoxyphenyl)methyl]benzamide
CID 20854229
4-N-[(4-methoxyphenyl)methyl]benzene-1,4-disulfonamide
CID 26527057
4-[[(4-acetamidophenyl)sulfonylamino]methyl]-N-[2-(4-methoxyphenyl)ethyl]benzamide
CID 27548773
N-benzyl-4-methoxybenzenesulfonamide
CID 741351
N-[(4-methoxyphenyl)methyl]-4-(methylamino)benzenesulfonamide
CID 43332057
4-[[(4-acetylphenyl)sulfonylamino]methyl]-N,N-dipropylbenzamide
CID 29373491
2-(4-methoxyphenyl)sulfonyl-N,N-bis(2-methylpropyl)acetamide
CID 86992855

Frequently Asked Questions

What is the IUPAC name of 4-[[(4-methoxyphenyl)sulfonylamino]methyl]-N,N-bis(2-methylpropyl)benzamide?
The IUPAC name of 4-[[(4-methoxyphenyl)sulfonylamino]methyl]-N,N-bis(2-methylpropyl)benzamide (CID 20854207) is 4-[[(4-methoxyphenyl)sulfonylamino]methyl]-N,N-bis(2-methylpropyl)benzamide.
What is the SMILES notation for 4-[[(4-methoxyphenyl)sulfonylamino]methyl]-N,N-bis(2-methylpropyl)benzamide?
The canonical SMILES for 4-[[(4-methoxyphenyl)sulfonylamino]methyl]-N,N-bis(2-methylpropyl)benzamide is COc1ccc(S(=O)(=O)NCc2ccc(C(=O)N(CC(C)C)CC(C)C)cc2)cc1.
What is the InChIKey of 4-[[(4-methoxyphenyl)sulfonylamino]methyl]-N,N-bis(2-methylpropyl)benzamide?
The InChIKey is GZZLHMLVWAUOQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H32N2O4S/c1-17(2)15-25(16-18(3)4)23(26)20-8-6-19(7-9-20)14-24-30(27,28)22-12-10-21(29-5)11-13-22/h6-13,17-18,24H,14-16H2,1-5H3.
What are the key properties of 4-[[(4-methoxyphenyl)sulfonylamino]methyl]-N,N-bis(2-methylpropyl)benzamide?
4-[[(4-methoxyphenyl)sulfonylamino]methyl]-N,N-bis(2-methylpropyl)benzamide has a molecular weight of 432.59 g/mol, XLogP of 3.93, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[(4-methoxyphenyl)sulfonylamino]methyl]-N,N-bis(2-methylpropyl)benzamide is sourced from PubChem (CID 20854207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).