N-[[2-[[ethyl(methyl)sulfamoyl]amino]phenyl]methyl]methanesulfonamide

C11H19N3O4S2 — CID 167823495

IUPACN-[[2-[[ethyl(methyl)sulfamoyl]amino]phenyl]methyl]methanesulfonamide
SMILESCCN(C)S(=O)(=O)Nc1ccccc1CNS(C)(=O)=O
InChIInChI=1S/C11H19N3O4S2/c1-4-14(2)20(17,18)13-11-8-6-5-7-10(11)9-12-19(3,15)16/h5-8,12-13H,4,9H2,1-3H3
InChIKeyXWXRUBGJPYRQAW-UHFFFAOYSA-N
MW321.42 g/mol
LogP0.34
Rot. Bonds7

About N-[[2-[[ethyl(methyl)sulfamoyl]amino]phenyl]methyl]methanesulfonamide

N-[[2-[[ethyl(methyl)sulfamoyl]amino]phenyl]methyl]methanesulfonamide (PubChem CID 167823495) has the molecular formula C11H19N3O4S2 and a molecular weight of 321.42 g/mol. Its IUPAC name is N-[[2-[[ethyl(methyl)sulfamoyl]amino]phenyl]methyl]methanesulfonamide.

Molecular Properties

Compound NameN-[[2-[[ethyl(methyl)sulfamoyl]amino]phenyl]methyl]methanesulfonamide
PubChem CID167823495
Molecular FormulaC11H19N3O4S2
Molecular Weight321.42 g/mol
Exact Mass321.08
IUPAC NameN-[[2-[[ethyl(methyl)sulfamoyl]amino]phenyl]methyl]methanesulfonamide
SMILESCCN(C)S(=O)(=O)Nc1ccccc1CNS(C)(=O)=O
InChIInChI=1S/C11H19N3O4S2/c1-4-14(2)20(17,18)13-11-8-6-5-7-10(11)9-12-19(3,15)16/h5-8,12-13H,4,9H2,1-3H3
InChIKeyXWXRUBGJPYRQAW-UHFFFAOYSA-N
XLogP0.34
TPSA95.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.42
LogP ≤ 50.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[[2-[[ethyl(methyl)sulfamoyl]amino]phenyl]methyl]methanesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[2-[[butyl(methyl)sulfamoyl]amino]phenyl]acetic acid
CID 62535155
N-[[2-(aminomethyl)phenyl]methyl]methanesulfonamide
CID 62949532
2-[2-(diethylsulfamoylamino)phenyl]acetic acid
CID 62535925
N-[(2-propan-2-ylphenyl)methyl]methanesulfonamide
CID 3329133
1-(dimethylsulfamoylamino)-2-(3,3,3-trifluoropropyl)benzene
CID 71921337
N-[2-(bromomethyl)phenyl]methanesulfonamide
CID 114296091
1-N,2-N-bis(2-ethylphenyl)benzene-1,2-disulfonamide
CID 25048038
1-amino-2-(diethylsulfamoylamino)benzene
CID 28783371
N-(2-ethylphenyl)-2-(methanesulfonamido)acetamide
CID 47013160
1-(aminomethyl)-2-[[methyl(propan-2-yl)sulfamoyl]amino]benzene
CID 54947668
[1-amino-2-[[ethyl(methyl)sulfamoyl]amino]ethyl]benzene
CID 119976145
2-[2-[[methyl(propan-2-yl)sulfamoyl]amino]phenyl]acetic acid
CID 62536120

Frequently Asked Questions

What is the IUPAC name of N-[[2-[[ethyl(methyl)sulfamoyl]amino]phenyl]methyl]methanesulfonamide?
The IUPAC name of N-[[2-[[ethyl(methyl)sulfamoyl]amino]phenyl]methyl]methanesulfonamide (CID 167823495) is N-[[2-[[ethyl(methyl)sulfamoyl]amino]phenyl]methyl]methanesulfonamide.
What is the SMILES notation for N-[[2-[[ethyl(methyl)sulfamoyl]amino]phenyl]methyl]methanesulfonamide?
The canonical SMILES for N-[[2-[[ethyl(methyl)sulfamoyl]amino]phenyl]methyl]methanesulfonamide is CCN(C)S(=O)(=O)Nc1ccccc1CNS(C)(=O)=O.
What is the InChIKey of N-[[2-[[ethyl(methyl)sulfamoyl]amino]phenyl]methyl]methanesulfonamide?
The InChIKey is XWXRUBGJPYRQAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O4S2/c1-4-14(2)20(17,18)13-11-8-6-5-7-10(11)9-12-19(3,15)16/h5-8,12-13H,4,9H2,1-3H3.
What are the key properties of N-[[2-[[ethyl(methyl)sulfamoyl]amino]phenyl]methyl]methanesulfonamide?
N-[[2-[[ethyl(methyl)sulfamoyl]amino]phenyl]methyl]methanesulfonamide has a molecular weight of 321.42 g/mol, XLogP of 0.34, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-[[ethyl(methyl)sulfamoyl]amino]phenyl]methyl]methanesulfonamide is sourced from PubChem (CID 167823495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).