N-(4-methoxyphenyl)-2-[(4-propan-2-yloxyphenyl)sulfonylamino]acetamide

C18H22N2O5S — CID 112998764

IUPACN-(4-methoxyphenyl)-2-[(4-propan-2-yloxyphenyl)sulfonylamino]acetamide
SMILESCOc1ccc(NC(=O)CNS(=O)(=O)c2ccc(OC(C)C)cc2)cc1
InChIInChI=1S/C18H22N2O5S/c1-13(2)25-16-8-10-17(11-9-16)26(22,23)19-12-18(21)20-14-4-6-15(24-3)7-5-14/h4-11,13,19H,12H2,1-3H3,(H,20,21)
InChIKeyGIBUZGCMUQRWAU-UHFFFAOYSA-N
MW378.45 g/mol
LogP2.40
Rot. Bonds8

About N-(4-methoxyphenyl)-2-[(4-propan-2-yloxyphenyl)sulfonylamino]acetamide

N-(4-methoxyphenyl)-2-[(4-propan-2-yloxyphenyl)sulfonylamino]acetamide (PubChem CID 112998764) has the molecular formula C18H22N2O5S and a molecular weight of 378.45 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-2-[(4-propan-2-yloxyphenyl)sulfonylamino]acetamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-2-[(4-propan-2-yloxyphenyl)sulfonylamino]acetamide
PubChem CID112998764
Molecular FormulaC18H22N2O5S
Molecular Weight378.45 g/mol
Exact Mass378.12
IUPAC NameN-(4-methoxyphenyl)-2-[(4-propan-2-yloxyphenyl)sulfonylamino]acetamide
SMILESCOc1ccc(NC(=O)CNS(=O)(=O)c2ccc(OC(C)C)cc2)cc1
InChIInChI=1S/C18H22N2O5S/c1-13(2)25-16-8-10-17(11-9-16)26(22,23)19-12-18(21)20-14-4-6-15(24-3)7-5-14/h4-11,13,19H,12H2,1-3H3,(H,20,21)
InChIKeyGIBUZGCMUQRWAU-UHFFFAOYSA-N
XLogP2.40
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.45
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-ethoxyphenyl)-2-[(4-propan-2-yloxyphenyl)sulfonylamino]acetamide
CID 112998900
N-(4-methoxyphenyl)-2-[(4-propan-2-ylphenyl)sulfonylamino]acetamide
CID 112998738
methyl 4-[[2-[(4-methoxyphenyl)sulfonylamino]acetyl]amino]benzoate
CID 24639142
N-(3,4-difluorophenyl)-2-[(4-propan-2-yloxyphenyl)sulfonylamino]acetamide
CID 113002373
2-[(4-methoxy-3-methylphenyl)sulfonylamino]-N-(4-methoxyphenyl)acetamide
CID 112998742
N-(3-acetamidophenyl)-2-[(4-methoxyphenyl)sulfonylamino]acetamide
CID 26584175
2-[(4-propan-2-yloxyphenyl)sulfonylamino]-N-prop-2-enylacetamide
CID 112990609
2-[(3-chloro-4-methoxyphenyl)sulfonylamino]-N-(4-methoxyphenyl)acetamide
CID 112998755
3-[(4-tert-butylphenyl)sulfonylamino]-N-(4-propan-2-yloxyphenyl)propanamide
CID 60516647
N-(2,3-dihydro-1H-inden-5-yl)-2-[(4-methoxyphenyl)sulfonylamino]acetamide
CID 24637643
N-[4-[(4-propan-2-yloxyphenyl)methylsulfamoyl]phenyl]acetamide
CID 53281637
2-[(4-acetamidophenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide
CID 112998688

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-2-[(4-propan-2-yloxyphenyl)sulfonylamino]acetamide?
The IUPAC name of N-(4-methoxyphenyl)-2-[(4-propan-2-yloxyphenyl)sulfonylamino]acetamide (CID 112998764) is N-(4-methoxyphenyl)-2-[(4-propan-2-yloxyphenyl)sulfonylamino]acetamide.
What is the SMILES notation for N-(4-methoxyphenyl)-2-[(4-propan-2-yloxyphenyl)sulfonylamino]acetamide?
The canonical SMILES for N-(4-methoxyphenyl)-2-[(4-propan-2-yloxyphenyl)sulfonylamino]acetamide is COc1ccc(NC(=O)CNS(=O)(=O)c2ccc(OC(C)C)cc2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-2-[(4-propan-2-yloxyphenyl)sulfonylamino]acetamide?
The InChIKey is GIBUZGCMUQRWAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O5S/c1-13(2)25-16-8-10-17(11-9-16)26(22,23)19-12-18(21)20-14-4-6-15(24-3)7-5-14/h4-11,13,19H,12H2,1-3H3,(H,20,21).
What are the key properties of N-(4-methoxyphenyl)-2-[(4-propan-2-yloxyphenyl)sulfonylamino]acetamide?
N-(4-methoxyphenyl)-2-[(4-propan-2-yloxyphenyl)sulfonylamino]acetamide has a molecular weight of 378.45 g/mol, XLogP of 2.40, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-2-[(4-propan-2-yloxyphenyl)sulfonylamino]acetamide is sourced from PubChem (CID 112998764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).