2-[(4-acetamidophenyl)sulfonylamino]-N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]acetamide

C23H30N4O6S — CID 24980751

IUPAC2-[(4-acetamidophenyl)sulfonylamino]-N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]acetamide
SMILESCOc1ccc(C(CNC(=O)CNS(=O)(=O)c2ccc(NC(C)=O)cc2)N2CCOCC2)cc1
InChIInChI=1S/C23H30N4O6S/c1-17(28)26-19-5-9-21(10-6-19)34(30,31)25-16-23(29)24-15-22(27-11-13-33-14-12-27)18-3-7-20(32-2)8-4-18/h3-10,22,25H,11-16H2,1-2H3,(H,24,29)(H,26,28)
InChIKeyXVOSTYRYXZPUMX-UHFFFAOYSA-N
MW490.58 g/mol
LogP1.12
Rot. Bonds10

About 2-[(4-acetamidophenyl)sulfonylamino]-N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]acetamide

2-[(4-acetamidophenyl)sulfonylamino]-N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]acetamide (PubChem CID 24980751) has the molecular formula C23H30N4O6S and a molecular weight of 490.58 g/mol. Its IUPAC name is 2-[(4-acetamidophenyl)sulfonylamino]-N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]acetamide.

Molecular Properties

Compound Name2-[(4-acetamidophenyl)sulfonylamino]-N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]acetamide
PubChem CID24980751
Molecular FormulaC23H30N4O6S
Molecular Weight490.58 g/mol
Exact Mass490.19
IUPAC Name2-[(4-acetamidophenyl)sulfonylamino]-N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]acetamide
SMILESCOc1ccc(C(CNC(=O)CNS(=O)(=O)c2ccc(NC(C)=O)cc2)N2CCOCC2)cc1
InChIInChI=1S/C23H30N4O6S/c1-17(28)26-19-5-9-21(10-6-19)34(30,31)25-16-23(29)24-15-22(27-11-13-33-14-12-27)18-3-7-20(32-2)8-4-18/h3-10,22,25H,11-16H2,1-2H3,(H,24,29)(H,26,28)
InChIKeyXVOSTYRYXZPUMX-UHFFFAOYSA-N
XLogP1.12
TPSA126.07 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds10
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500490.58
LogP ≤ 51.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Related Compounds

3-[(4-bromophenyl)sulfonylamino]-N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]propanamide
CID 25163879
N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]propanamide
CID 43006637
4-bromo-N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]benzenesulfonamide
CID 44903369
4-cyano-N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]benzenesulfonamide
CID 55352588
3-(4-methoxyphenyl)-N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]propanamide
CID 44892273
N-[4-(2-morpholin-4-ylpropylsulfamoyl)phenyl]acetamide
CID 43064581
(2S)-N-[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-2-[(4-methoxyphenyl)sulfonylamino]-3-methylbutanamide
CID 55937120
N-[(2S)-2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-4-(phenylcarbamoylamino)benzamide
CID 95343423
ethyl N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]carbamate
CID 112502614
2-(4-iodophenoxy)-N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]acetamide
CID 112793405
N-[(2S)-2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-2-(4-methoxyphenyl)acetamide
CID 30834692
N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanamide
CID 24980638

Frequently Asked Questions

What is the IUPAC name of 2-[(4-acetamidophenyl)sulfonylamino]-N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]acetamide?
The IUPAC name of 2-[(4-acetamidophenyl)sulfonylamino]-N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]acetamide (CID 24980751) is 2-[(4-acetamidophenyl)sulfonylamino]-N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]acetamide.
What is the SMILES notation for 2-[(4-acetamidophenyl)sulfonylamino]-N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]acetamide?
The canonical SMILES for 2-[(4-acetamidophenyl)sulfonylamino]-N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]acetamide is COc1ccc(C(CNC(=O)CNS(=O)(=O)c2ccc(NC(C)=O)cc2)N2CCOCC2)cc1.
What is the InChIKey of 2-[(4-acetamidophenyl)sulfonylamino]-N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]acetamide?
The InChIKey is XVOSTYRYXZPUMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N4O6S/c1-17(28)26-19-5-9-21(10-6-19)34(30,31)25-16-23(29)24-15-22(27-11-13-33-14-12-27)18-3-7-20(32-2)8-4-18/h3-10,22,25H,11-16H2,1-2H3,(H,24,29)(H,26,28).
What are the key properties of 2-[(4-acetamidophenyl)sulfonylamino]-N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]acetamide?
2-[(4-acetamidophenyl)sulfonylamino]-N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]acetamide has a molecular weight of 490.58 g/mol, XLogP of 1.12, 10 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-acetamidophenyl)sulfonylamino]-N-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]acetamide is sourced from PubChem (CID 24980751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).