N-[3-(dimethylsulfamoyl)phenyl]-2-[1-(2-methoxyphenyl)ethyl-methylamino]acetamide

C20H27N3O4S — CID 55628506

IUPACN-[3-(dimethylsulfamoyl)phenyl]-2-[1-(2-methoxyphenyl)ethyl-methylamino]acetamide
SMILESCOc1ccccc1C(C)N(C)CC(=O)Nc1cccc(S(=O)(=O)N(C)C)c1
InChIInChI=1S/C20H27N3O4S/c1-15(18-11-6-7-12-19(18)27-5)23(4)14-20(24)21-16-9-8-10-17(13-16)28(25,26)22(2)3/h6-13,15H,14H2,1-5H3,(H,21,24)
InChIKeyMTOLHBZUMUZZCE-UHFFFAOYSA-N
MW405.52 g/mol
LogP2.58
Rot. Bonds8

About N-[3-(dimethylsulfamoyl)phenyl]-2-[1-(2-methoxyphenyl)ethyl-methylamino]acetamide

N-[3-(dimethylsulfamoyl)phenyl]-2-[1-(2-methoxyphenyl)ethyl-methylamino]acetamide (PubChem CID 55628506) has the molecular formula C20H27N3O4S and a molecular weight of 405.52 g/mol. Its IUPAC name is N-[3-(dimethylsulfamoyl)phenyl]-2-[1-(2-methoxyphenyl)ethyl-methylamino]acetamide.

Molecular Properties

Compound NameN-[3-(dimethylsulfamoyl)phenyl]-2-[1-(2-methoxyphenyl)ethyl-methylamino]acetamide
PubChem CID55628506
Molecular FormulaC20H27N3O4S
Molecular Weight405.52 g/mol
Exact Mass405.17
IUPAC NameN-[3-(dimethylsulfamoyl)phenyl]-2-[1-(2-methoxyphenyl)ethyl-methylamino]acetamide
SMILESCOc1ccccc1C(C)N(C)CC(=O)Nc1cccc(S(=O)(=O)N(C)C)c1
InChIInChI=1S/C20H27N3O4S/c1-15(18-11-6-7-12-19(18)27-5)23(4)14-20(24)21-16-9-8-10-17(13-16)28(25,26)22(2)3/h6-13,15H,14H2,1-5H3,(H,21,24)
InChIKeyMTOLHBZUMUZZCE-UHFFFAOYSA-N
XLogP2.58
TPSA78.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.52
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-(dimethylsulfamoyl)phenyl]-2-(2-methoxyphenoxy)acetamide
CID 4797644
N-[3-(dimethylsulfamoyl)phenyl]-2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]acetamide
CID 9049077
N-(2,6-dimethylphenyl)-2-[1-(2-methoxyphenyl)ethyl-methylamino]acetamide
CID 86931156
[2-[3-(dimethylsulfamoyl)anilino]-2-oxoethyl]-[(1R)-1-(2-methoxy-5-methylphenyl)ethyl]azanium
CID 8768901
N-[3-(dimethylsulfamoyl)phenyl]-2-[(2-methoxyphenyl)methyl-(thiophen-2-ylmethyl)amino]acetamide
CID 31479938
[(2S)-1-[3-(dimethylsulfamoyl)anilino]-1-oxopropan-2-yl] 2-methoxybenzoate
CID 7811653
2-(2-bromophenoxy)-N-[3-(dimethylsulfamoyl)phenyl]acetamide
CID 7847691
2-[1-(2-methoxyphenyl)ethyl-methylamino]-N-(4-pyrrolidin-1-ylphenyl)acetamide
CID 46405645
2-[1-(2-chlorophenyl)ethylamino]-N-[3-(dimethylsulfamoyl)phenyl]acetamide
CID 51171745
4-amino-N-[3-(dimethylsulfamoyl)phenyl]-3-methoxybutanamide
CID 103154687
2-(3,5-dimethoxyphenoxy)-N-[3-(dimethylsulfamoyl)phenyl]acetamide
CID 7713817
N-[3-(dimethylsulfamoyl)phenyl]-2-(2-propoxyphenoxy)acetamide
CID 8961619

Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylsulfamoyl)phenyl]-2-[1-(2-methoxyphenyl)ethyl-methylamino]acetamide?
The IUPAC name of N-[3-(dimethylsulfamoyl)phenyl]-2-[1-(2-methoxyphenyl)ethyl-methylamino]acetamide (CID 55628506) is N-[3-(dimethylsulfamoyl)phenyl]-2-[1-(2-methoxyphenyl)ethyl-methylamino]acetamide.
What is the SMILES notation for N-[3-(dimethylsulfamoyl)phenyl]-2-[1-(2-methoxyphenyl)ethyl-methylamino]acetamide?
The canonical SMILES for N-[3-(dimethylsulfamoyl)phenyl]-2-[1-(2-methoxyphenyl)ethyl-methylamino]acetamide is COc1ccccc1C(C)N(C)CC(=O)Nc1cccc(S(=O)(=O)N(C)C)c1.
What is the InChIKey of N-[3-(dimethylsulfamoyl)phenyl]-2-[1-(2-methoxyphenyl)ethyl-methylamino]acetamide?
The InChIKey is MTOLHBZUMUZZCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N3O4S/c1-15(18-11-6-7-12-19(18)27-5)23(4)14-20(24)21-16-9-8-10-17(13-16)28(25,26)22(2)3/h6-13,15H,14H2,1-5H3,(H,21,24).
What are the key properties of N-[3-(dimethylsulfamoyl)phenyl]-2-[1-(2-methoxyphenyl)ethyl-methylamino]acetamide?
N-[3-(dimethylsulfamoyl)phenyl]-2-[1-(2-methoxyphenyl)ethyl-methylamino]acetamide has a molecular weight of 405.52 g/mol, XLogP of 2.58, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylsulfamoyl)phenyl]-2-[1-(2-methoxyphenyl)ethyl-methylamino]acetamide is sourced from PubChem (CID 55628506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).