N-[5-(diethylsulfamoyl)-2-(methylamino)phenyl]-2-(2-methoxyethylamino)acetamide

C16H28N4O4S — CID 119682122

IUPACN-[5-(diethylsulfamoyl)-2-(methylamino)phenyl]-2-(2-methoxyethylamino)acetamide
SMILESCCN(CC)S(=O)(=O)c1ccc(NC)c(NC(=O)CNCCOC)c1
InChIInChI=1S/C16H28N4O4S/c1-5-20(6-2)25(22,23)13-7-8-14(17-3)15(11-13)19-16(21)12-18-9-10-24-4/h7-8,11,17-18H,5-6,9-10,12H2,1-4H3,(H,19,21)
InChIKeyVSDRIOTZKNZUJA-UHFFFAOYSA-N
MW372.49 g/mol
LogP0.93
Rot. Bonds11

About N-[5-(diethylsulfamoyl)-2-(methylamino)phenyl]-2-(2-methoxyethylamino)acetamide

N-[5-(diethylsulfamoyl)-2-(methylamino)phenyl]-2-(2-methoxyethylamino)acetamide (PubChem CID 119682122) has the molecular formula C16H28N4O4S and a molecular weight of 372.49 g/mol. Its IUPAC name is N-[5-(diethylsulfamoyl)-2-(methylamino)phenyl]-2-(2-methoxyethylamino)acetamide.

Molecular Properties

Compound NameN-[5-(diethylsulfamoyl)-2-(methylamino)phenyl]-2-(2-methoxyethylamino)acetamide
PubChem CID119682122
Molecular FormulaC16H28N4O4S
Molecular Weight372.49 g/mol
Exact Mass372.18
IUPAC NameN-[5-(diethylsulfamoyl)-2-(methylamino)phenyl]-2-(2-methoxyethylamino)acetamide
SMILESCCN(CC)S(=O)(=O)c1ccc(NC)c(NC(=O)CNCCOC)c1
InChIInChI=1S/C16H28N4O4S/c1-5-20(6-2)25(22,23)13-7-8-14(17-3)15(11-13)19-16(21)12-18-9-10-24-4/h7-8,11,17-18H,5-6,9-10,12H2,1-4H3,(H,19,21)
InChIKeyVSDRIOTZKNZUJA-UHFFFAOYSA-N
XLogP0.93
TPSA99.77 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds11
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.49
LogP ≤ 50.93
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[5-(diethylsulfamoyl)-2-(propylamino)phenyl]-2-(methylamino)acetamide;hydrochloride
CID 119685367
2-(4-aminophenyl)-N-[5-(diethylsulfamoyl)-2-(methylamino)phenyl]acetamide
CID 119682102
N-[4-chloro-3-(diethylsulfamoyl)phenyl]-2-(2-methoxyethylamino)acetamide
CID 119679914
(2S)-2-amino-N-[5-(diethylsulfamoyl)-2-(methylamino)phenyl]propanamide
CID 119267327
2-chloro-N-[5-(diethylsulfamoyl)-2-methylphenyl]acetamide
CID 3606084
2-[(1R,2S,4S)-2-bicyclo[2.2.1]heptanyl]-N-[5-(diethylsulfamoyl)-2-(methylamino)phenyl]acetamide
CID 51933846
N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-2-(methylamino)acetamide
CID 119683526
methyl 3-[[2-[5-(diethylsulfamoyl)-2-methylanilino]acetyl]amino]-4-methylbenzoate
CID 17392379
N,N-diethyl-4-methoxy-3-(methylamino)benzenesulfonamide
CID 35582178
N-[5-(diethylsulfamoyl)-2-(ethylamino)phenyl]-4-(methylamino)butanamide
CID 119680561
N-[5-(diethylsulfamoyl)-2-methylphenyl]-2-(2,5-dioxopyrrolidin-1-yl)acetamide
CID 7819474
2-amino-N-[5-(diethylsulfamoyl)-2-(methylamino)phenyl]pentanamide;hydrochloride
CID 119267336

Frequently Asked Questions

What is the IUPAC name of N-[5-(diethylsulfamoyl)-2-(methylamino)phenyl]-2-(2-methoxyethylamino)acetamide?
The IUPAC name of N-[5-(diethylsulfamoyl)-2-(methylamino)phenyl]-2-(2-methoxyethylamino)acetamide (CID 119682122) is N-[5-(diethylsulfamoyl)-2-(methylamino)phenyl]-2-(2-methoxyethylamino)acetamide.
What is the SMILES notation for N-[5-(diethylsulfamoyl)-2-(methylamino)phenyl]-2-(2-methoxyethylamino)acetamide?
The canonical SMILES for N-[5-(diethylsulfamoyl)-2-(methylamino)phenyl]-2-(2-methoxyethylamino)acetamide is CCN(CC)S(=O)(=O)c1ccc(NC)c(NC(=O)CNCCOC)c1.
What is the InChIKey of N-[5-(diethylsulfamoyl)-2-(methylamino)phenyl]-2-(2-methoxyethylamino)acetamide?
The InChIKey is VSDRIOTZKNZUJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N4O4S/c1-5-20(6-2)25(22,23)13-7-8-14(17-3)15(11-13)19-16(21)12-18-9-10-24-4/h7-8,11,17-18H,5-6,9-10,12H2,1-4H3,(H,19,21).
What are the key properties of N-[5-(diethylsulfamoyl)-2-(methylamino)phenyl]-2-(2-methoxyethylamino)acetamide?
N-[5-(diethylsulfamoyl)-2-(methylamino)phenyl]-2-(2-methoxyethylamino)acetamide has a molecular weight of 372.49 g/mol, XLogP of 0.93, 11 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(diethylsulfamoyl)-2-(methylamino)phenyl]-2-(2-methoxyethylamino)acetamide is sourced from PubChem (CID 119682122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).