N'-(ethylsulfamoyl)-N-(2-methoxyethyl)ethane-1,2-diamine

C7H19N3O3S — CID 114811311

IUPACN'-(ethylsulfamoyl)-N-(2-methoxyethyl)ethane-1,2-diamine
SMILESCCNS(=O)(=O)NCCNCCOC
InChIInChI=1S/C7H19N3O3S/c1-3-9-14(11,12)10-5-4-8-6-7-13-2/h8-10H,3-7H2,1-2H3
InChIKeyRWXBTHSWJDVMGN-UHFFFAOYSA-N
MW225.31 g/mol
LogP-1.33
Rot. Bonds9

About N'-(ethylsulfamoyl)-N-(2-methoxyethyl)ethane-1,2-diamine

N'-(ethylsulfamoyl)-N-(2-methoxyethyl)ethane-1,2-diamine (PubChem CID 114811311) has the molecular formula C7H19N3O3S and a molecular weight of 225.31 g/mol. Its IUPAC name is N'-(ethylsulfamoyl)-N-(2-methoxyethyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-(ethylsulfamoyl)-N-(2-methoxyethyl)ethane-1,2-diamine
PubChem CID114811311
Molecular FormulaC7H19N3O3S
Molecular Weight225.31 g/mol
Exact Mass225.11
IUPAC NameN'-(ethylsulfamoyl)-N-(2-methoxyethyl)ethane-1,2-diamine
SMILESCCNS(=O)(=O)NCCNCCOC
InChIInChI=1S/C7H19N3O3S/c1-3-9-14(11,12)10-5-4-8-6-7-13-2/h8-10H,3-7H2,1-2H3
InChIKeyRWXBTHSWJDVMGN-UHFFFAOYSA-N
XLogP-1.33
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.31
LogP ≤ 5-1.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N2-(2-Methoxyethyl)-N1,N1-dimethyl-1,2-ethanediamine
CID 23313977
2-[2-Aminoethyl(2-methoxyethylsulfamoyl)amino]-1,1-difluoroethane
CID 107493828
2-[2-Aminoethyl(2-methoxyethylsulfamoyl)amino]-1,1,1-trifluoroethane
CID 107493915
N-(2-methoxyethyl)-N'-(2,2,2-trifluoroethylsulfamoyl)ethane-1,2-diamine
CID 113637462
2-[[2-Aminoethyl(2-methoxyethyl)sulfamoyl]amino]-1,1,1-trifluoroethane
CID 113637720
N~1~,N~2~-Bis(2-methoxyethyl)ethane-1,2-diamine
CID 13599000
N'-[2-(2-methoxyethylamino)ethyl]ethane-1,2-diamine
CID 15685487
N',N'-bis(2-methoxyethyl)-N-methylethane-1,2-diamine
CID 18965059
N-ethyl-N',N'-bis(2-methoxyethyl)ethane-1,2-diamine
CID 18965125
N,N'-bis(2-methoxyethyl)-N'-methylethane-1,2-diamine
CID 21754267
N'-ethyl-N,N'-bis(2-methoxyethyl)ethane-1,2-diamine
CID 21754279
N-(2-methoxyethyl)piperazine-1-sulfonamide
CID 28775604

Frequently Asked Questions

What is the IUPAC name of N'-(ethylsulfamoyl)-N-(2-methoxyethyl)ethane-1,2-diamine?
The IUPAC name of N'-(ethylsulfamoyl)-N-(2-methoxyethyl)ethane-1,2-diamine (CID 114811311) is N'-(ethylsulfamoyl)-N-(2-methoxyethyl)ethane-1,2-diamine.
What is the SMILES notation for N'-(ethylsulfamoyl)-N-(2-methoxyethyl)ethane-1,2-diamine?
The canonical SMILES for N'-(ethylsulfamoyl)-N-(2-methoxyethyl)ethane-1,2-diamine is CCNS(=O)(=O)NCCNCCOC.
What is the InChIKey of N'-(ethylsulfamoyl)-N-(2-methoxyethyl)ethane-1,2-diamine?
The InChIKey is RWXBTHSWJDVMGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H19N3O3S/c1-3-9-14(11,12)10-5-4-8-6-7-13-2/h8-10H,3-7H2,1-2H3.
What are the key properties of N'-(ethylsulfamoyl)-N-(2-methoxyethyl)ethane-1,2-diamine?
N'-(ethylsulfamoyl)-N-(2-methoxyethyl)ethane-1,2-diamine has a molecular weight of 225.31 g/mol, XLogP of -1.33, 9 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(ethylsulfamoyl)-N-(2-methoxyethyl)ethane-1,2-diamine is sourced from PubChem (CID 114811311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).