2-[(3-acetamido-4-methoxyphenyl)sulfonylamino]-N-propylbenzamide

C19H23N3O5S — CID 4792730

IUPAC2-[(3-acetamido-4-methoxyphenyl)sulfonylamino]-N-propylbenzamide
SMILESCCCNC(=O)c1ccccc1NS(=O)(=O)c1ccc(OC)c(NC(C)=O)c1
InChIInChI=1S/C19H23N3O5S/c1-4-11-20-19(24)15-7-5-6-8-16(15)22-28(25,26)14-9-10-18(27-3)17(12-14)21-13(2)23/h5-10,12,22H,4,11H2,1-3H3,(H,20,24)(H,21,23)
InChIKeyDAXLHDUYTQSOTH-UHFFFAOYSA-N
MW405.48 g/mol
LogP2.59
Rot. Bonds8

About 2-[(3-acetamido-4-methoxyphenyl)sulfonylamino]-N-propylbenzamide

2-[(3-acetamido-4-methoxyphenyl)sulfonylamino]-N-propylbenzamide (PubChem CID 4792730) has the molecular formula C19H23N3O5S and a molecular weight of 405.48 g/mol. Its IUPAC name is 2-[(3-acetamido-4-methoxyphenyl)sulfonylamino]-N-propylbenzamide.

Molecular Properties

Compound Name2-[(3-acetamido-4-methoxyphenyl)sulfonylamino]-N-propylbenzamide
PubChem CID4792730
Molecular FormulaC19H23N3O5S
Molecular Weight405.48 g/mol
Exact Mass405.14
IUPAC Name2-[(3-acetamido-4-methoxyphenyl)sulfonylamino]-N-propylbenzamide
SMILESCCCNC(=O)c1ccccc1NS(=O)(=O)c1ccc(OC)c(NC(C)=O)c1
InChIInChI=1S/C19H23N3O5S/c1-4-11-20-19(24)15-7-5-6-8-16(15)22-28(25,26)14-9-10-18(27-3)17(12-14)21-13(2)23/h5-10,12,22H,4,11H2,1-3H3,(H,20,24)(H,21,23)
InChIKeyDAXLHDUYTQSOTH-UHFFFAOYSA-N
XLogP2.59
TPSA113.60 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.48
LogP ≤ 52.59
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(3-acetamido-4-methoxyphenyl)sulfonylamino]-N-(2-methylpropyl)benzamide
CID 31324729
ethyl 2-[(3-acetamido-4-methoxyphenyl)sulfonylamino]benzoate
CID 26969690
2-[(3-acetamido-4-methoxyphenyl)sulfonylamino]-N-(4-methylphenyl)benzamide
CID 71903202
2-methoxy-5-[(2-methylphenyl)sulfamoyl]-N-propylbenzamide
CID 27261659
N-[4-[(2-acetylphenyl)sulfamoyl]-2-methoxyphenyl]acetamide
CID 8603481
N-[2-methoxy-5-[(2-phenoxyphenyl)sulfamoyl]phenyl]acetamide
CID 71903158
2-[(3-nitrophenyl)sulfonylamino]-N-propylbenzamide
CID 2966829
N-[5-[[2-(4-ethoxyphenoxy)phenyl]sulfamoyl]-2-methoxyphenyl]acetamide
CID 17426332
N-[2-methoxy-5-[(2-methoxy-5-methylphenyl)sulfamoyl]phenyl]acetamide
CID 7343262
N-(3-acetamido-4-methoxyphenyl)-2-(methanesulfonamido)benzamide
CID 25484331
3-acetamido-4-methoxy-N-propylbenzamide
CID 110764204
N-[5-[[2-(2-chlorophenoxy)phenyl]sulfamoyl]-2-methoxyphenyl]acetamide
CID 24514729

Frequently Asked Questions

What is the IUPAC name of 2-[(3-acetamido-4-methoxyphenyl)sulfonylamino]-N-propylbenzamide?
The IUPAC name of 2-[(3-acetamido-4-methoxyphenyl)sulfonylamino]-N-propylbenzamide (CID 4792730) is 2-[(3-acetamido-4-methoxyphenyl)sulfonylamino]-N-propylbenzamide.
What is the SMILES notation for 2-[(3-acetamido-4-methoxyphenyl)sulfonylamino]-N-propylbenzamide?
The canonical SMILES for 2-[(3-acetamido-4-methoxyphenyl)sulfonylamino]-N-propylbenzamide is CCCNC(=O)c1ccccc1NS(=O)(=O)c1ccc(OC)c(NC(C)=O)c1.
What is the InChIKey of 2-[(3-acetamido-4-methoxyphenyl)sulfonylamino]-N-propylbenzamide?
The InChIKey is DAXLHDUYTQSOTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O5S/c1-4-11-20-19(24)15-7-5-6-8-16(15)22-28(25,26)14-9-10-18(27-3)17(12-14)21-13(2)23/h5-10,12,22H,4,11H2,1-3H3,(H,20,24)(H,21,23).
What are the key properties of 2-[(3-acetamido-4-methoxyphenyl)sulfonylamino]-N-propylbenzamide?
2-[(3-acetamido-4-methoxyphenyl)sulfonylamino]-N-propylbenzamide has a molecular weight of 405.48 g/mol, XLogP of 2.59, 8 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-acetamido-4-methoxyphenyl)sulfonylamino]-N-propylbenzamide is sourced from PubChem (CID 4792730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).