N-(4-tert-butylphenyl)-2-[(3-methoxyphenyl)sulfonylamino]acetamide

C19H24N2O4S — CID 984331

IUPACN-(4-tert-butylphenyl)-2-[(3-methoxyphenyl)sulfonylamino]acetamide
SMILESCOc1cccc(S(=O)(=O)NCC(=O)Nc2ccc(C(C)(C)C)cc2)c1
InChIInChI=1S/C19H24N2O4S/c1-19(2,3)14-8-10-15(11-9-14)21-18(22)13-20-26(23,24)17-7-5-6-16(12-17)25-4/h5-12,20H,13H2,1-4H3,(H,21,22)
InChIKeyILSJKEHOESHENJ-UHFFFAOYSA-N
MW376.48 g/mol
LogP2.91
Rot. Bonds6

About N-(4-tert-butylphenyl)-2-[(3-methoxyphenyl)sulfonylamino]acetamide

N-(4-tert-butylphenyl)-2-[(3-methoxyphenyl)sulfonylamino]acetamide (PubChem CID 984331) has the molecular formula C19H24N2O4S and a molecular weight of 376.48 g/mol. Its IUPAC name is N-(4-tert-butylphenyl)-2-[(3-methoxyphenyl)sulfonylamino]acetamide.

Molecular Properties

Compound NameN-(4-tert-butylphenyl)-2-[(3-methoxyphenyl)sulfonylamino]acetamide
PubChem CID984331
Molecular FormulaC19H24N2O4S
Molecular Weight376.48 g/mol
Exact Mass376.15
IUPAC NameN-(4-tert-butylphenyl)-2-[(3-methoxyphenyl)sulfonylamino]acetamide
SMILESCOc1cccc(S(=O)(=O)NCC(=O)Nc2ccc(C(C)(C)C)cc2)c1
InChIInChI=1S/C19H24N2O4S/c1-19(2,3)14-8-10-15(11-9-14)21-18(22)13-20-26(23,24)17-7-5-6-16(12-17)25-4/h5-12,20H,13H2,1-4H3,(H,21,22)
InChIKeyILSJKEHOESHENJ-UHFFFAOYSA-N
XLogP2.91
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 ≤ 52.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

Act-462206
CID 40924317
N-(3,4-Dimethylphenyl)-2-[N-(2-phenylethyl)3,4-dimethoxybenzenesulfonamido]acetamide
CID 1208429
N~1~-(3-methoxyphenyl)-N~2~-[(4-methoxyphenyl)sulfonyl]-N~2~-(2-phenylethyl)glycinamide
CID 1359892
2-[N-(4-Methoxyphenyl)3,4-dimethoxybenzenesulfonamido]-N-(1-phenylethyl)acetamide
CID 2860019
N-(2,5-Dimethylphenyl)-2-[N-(2-phenylethyl)4-methoxybenzenesulfonamido]acetamide
CID 2878889
2-(2-ethyl-N-(4-methylphenyl)sulfonylanilino)-N-[(4-methoxyphenyl)methyl]acetamide
CID 1009982
N-(2-Amino-phenyl)-3-[4-(4-methoxy-benzenesulfonylamino)-phenyl]-acrylamide
CID 11112665
N-[[4-(4-acetylpiperazin-1-yl)-2-fluorophenyl]methyl]-N-cyclobutyl-3-methoxybenzenesulfonamide
CID 89659441
1-(2,5-Dimethoxy-benzenesulfonyl)-piperidine-4-carboxylic acid (3,4-dimethyl-phenyl)-amide
CID 649165
1-((4-methoxyphenyl)sulfonyl)-N-(p-tolyl)pyrrolidine-2-carboxamide
CID 651337
N-(3-methoxyphenyl)-2-[methyl-(4-methylphenyl)sulfonylamino]acetamide
CID 882050
N-(2-methoxy-4-{[(3-methylphenyl)amino]sulfonyl}phenyl)propanamide
CID 889176

Frequently Asked Questions

What is the IUPAC name of N-(4-tert-butylphenyl)-2-[(3-methoxyphenyl)sulfonylamino]acetamide?
The IUPAC name of N-(4-tert-butylphenyl)-2-[(3-methoxyphenyl)sulfonylamino]acetamide (CID 984331) is N-(4-tert-butylphenyl)-2-[(3-methoxyphenyl)sulfonylamino]acetamide.
What is the SMILES notation for N-(4-tert-butylphenyl)-2-[(3-methoxyphenyl)sulfonylamino]acetamide?
The canonical SMILES for N-(4-tert-butylphenyl)-2-[(3-methoxyphenyl)sulfonylamino]acetamide is COc1cccc(S(=O)(=O)NCC(=O)Nc2ccc(C(C)(C)C)cc2)c1.
What is the InChIKey of N-(4-tert-butylphenyl)-2-[(3-methoxyphenyl)sulfonylamino]acetamide?
The InChIKey is ILSJKEHOESHENJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4S/c1-19(2,3)14-8-10-15(11-9-14)21-18(22)13-20-26(23,24)17-7-5-6-16(12-17)25-4/h5-12,20H,13H2,1-4H3,(H,21,22).
What are the key properties of N-(4-tert-butylphenyl)-2-[(3-methoxyphenyl)sulfonylamino]acetamide?
N-(4-tert-butylphenyl)-2-[(3-methoxyphenyl)sulfonylamino]acetamide has a molecular weight of 376.48 g/mol, XLogP of 2.91, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-tert-butylphenyl)-2-[(3-methoxyphenyl)sulfonylamino]acetamide is sourced from PubChem (CID 984331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).