[2-methoxyethoxysulfamoyl(methyl)amino]methylbenzene

C11H18N2O4S — CID 82715155

IUPAC[2-methoxyethoxysulfamoyl(methyl)amino]methylbenzene
SMILESCOCCONS(=O)(=O)N(C)Cc1ccccc1
InChIInChI=1S/C11H18N2O4S/c1-13(10-11-6-4-3-5-7-11)18(14,15)12-17-9-8-16-2/h3-7,12H,8-10H2,1-2H3
InChIKeyGPGLVLRNGRXKRQ-UHFFFAOYSA-N
MW274.34 g/mol
LogP0.53
Rot. Bonds8

About [2-methoxyethoxysulfamoyl(methyl)amino]methylbenzene

[2-methoxyethoxysulfamoyl(methyl)amino]methylbenzene (PubChem CID 82715155) has the molecular formula C11H18N2O4S and a molecular weight of 274.34 g/mol. Its IUPAC name is [2-methoxyethoxysulfamoyl(methyl)amino]methylbenzene.

Molecular Properties

Compound Name[2-methoxyethoxysulfamoyl(methyl)amino]methylbenzene
PubChem CID82715155
Molecular FormulaC11H18N2O4S
Molecular Weight274.34 g/mol
Exact Mass274.10
IUPAC Name[2-methoxyethoxysulfamoyl(methyl)amino]methylbenzene
SMILESCOCCONS(=O)(=O)N(C)Cc1ccccc1
InChIInChI=1S/C11H18N2O4S/c1-13(10-11-6-4-3-5-7-11)18(14,15)12-17-9-8-16-2/h3-7,12H,8-10H2,1-2H3
InChIKeyGPGLVLRNGRXKRQ-UHFFFAOYSA-N
XLogP0.53
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.34
LogP ≤ 50.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[[benzyl(methyl)sulfamoyl]amino]oxyacetamide
CID 112673453
[methyl-[2-(methylamino)ethylsulfamoyl]amino]methylbenzene
CID 62659313
[methyl-[[4-(methylamino)cyclohexyl]sulfamoyl]amino]methylbenzene
CID 79118112
[methyl-[[2-methyl-3-(methylamino)propyl]sulfamoyl]amino]methylbenzene
CID 115302718
(2S)-3-[[benzyl(methyl)sulfamoyl]amino]-2-hydroxypropanoic acid
CID 107835221
2-[[[benzyl(methyl)sulfamoyl]amino]methyl]-3-methylbutanoic acid
CID 65220733
4-[[benzyl(methyl)sulfamoyl]amino]-3-methylbutanoic acid
CID 81066544
methyl 2-[benzyl(methyl)sulfamoyl]propanoate
CID 10038832
[2-(ethylamino)ethylsulfamoyl-methylamino]methylbenzene
CID 62664041
2-[[benzyl(methyl)sulfamoyl]amino]-3-hydroxypropanoic acid
CID 43245147
2-methoxy-N-phenylmethoxyethanesulfonamide
CID 64973771
[(1-hydroxy-2-methylpropan-2-yl)sulfamoyl-methylamino]methylbenzene
CID 43501816

Frequently Asked Questions

What is the IUPAC name of [2-methoxyethoxysulfamoyl(methyl)amino]methylbenzene?
The IUPAC name of [2-methoxyethoxysulfamoyl(methyl)amino]methylbenzene (CID 82715155) is [2-methoxyethoxysulfamoyl(methyl)amino]methylbenzene.
What is the SMILES notation for [2-methoxyethoxysulfamoyl(methyl)amino]methylbenzene?
The canonical SMILES for [2-methoxyethoxysulfamoyl(methyl)amino]methylbenzene is COCCONS(=O)(=O)N(C)Cc1ccccc1.
What is the InChIKey of [2-methoxyethoxysulfamoyl(methyl)amino]methylbenzene?
The InChIKey is GPGLVLRNGRXKRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O4S/c1-13(10-11-6-4-3-5-7-11)18(14,15)12-17-9-8-16-2/h3-7,12H,8-10H2,1-2H3.
What are the key properties of [2-methoxyethoxysulfamoyl(methyl)amino]methylbenzene?
[2-methoxyethoxysulfamoyl(methyl)amino]methylbenzene has a molecular weight of 274.34 g/mol, XLogP of 0.53, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-methoxyethoxysulfamoyl(methyl)amino]methylbenzene is sourced from PubChem (CID 82715155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).