1-[2-methoxyethyl(methyl)amino]-2-(sulfamoylamino)ethane

C6H17N3O3S — CID 112689073

IUPAC1-[2-methoxyethyl(methyl)amino]-2-(sulfamoylamino)ethane
SMILESCOCCN(C)CCNS(N)(=O)=O
InChIInChI=1S/C6H17N3O3S/c1-9(5-6-12-2)4-3-8-13(7,10)11/h8H,3-6H2,1-2H3,(H2,7,10,11)
InChIKeyPGVRMEZTVDAUND-UHFFFAOYSA-N
MW211.29 g/mol
LogP-1.64
Rot. Bonds7

About 1-[2-methoxyethyl(methyl)amino]-2-(sulfamoylamino)ethane

1-[2-methoxyethyl(methyl)amino]-2-(sulfamoylamino)ethane (PubChem CID 112689073) has the molecular formula C6H17N3O3S and a molecular weight of 211.29 g/mol. Its IUPAC name is 1-[2-methoxyethyl(methyl)amino]-2-(sulfamoylamino)ethane.

Molecular Properties

Compound Name1-[2-methoxyethyl(methyl)amino]-2-(sulfamoylamino)ethane
PubChem CID112689073
Molecular FormulaC6H17N3O3S
Molecular Weight211.29 g/mol
Exact Mass211.10
IUPAC Name1-[2-methoxyethyl(methyl)amino]-2-(sulfamoylamino)ethane
SMILESCOCCN(C)CCNS(N)(=O)=O
InChIInChI=1S/C6H17N3O3S/c1-9(5-6-12-2)4-3-8-13(7,10)11/h8H,3-6H2,1-2H3,(H2,7,10,11)
InChIKeyPGVRMEZTVDAUND-UHFFFAOYSA-N
XLogP-1.64
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.29
LogP ≤ 5-1.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1,2-Ethanediamine, N,N-bis(2-methoxyethyl)-
CID 7138275
(2-Aminoethyl)(2-methoxyethyl)methylamine
CID 23144321
N2-(2-Methoxyethyl)-N1,N1-dimethyl-1,2-ethanediamine
CID 23313977
N-[2-(4-methylmorpholin-4-ium-4-yl)ethyl]sulfamoyl fluoride
CID 166849929
N,N-bis(2-aminoethyl)-2-methoxyethylamine
CID 62924013
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',N'-bis(2-methoxyethyl)-N-methylethane-1,2-diamine
CID 18965059
N1-ethyl-N1-(2-methoxyethyl)-1,2-Ethanediamine
CID 18965091
N-ethyl-N',N'-bis(2-methoxyethyl)ethane-1,2-diamine
CID 18965125

Frequently Asked Questions

What is the IUPAC name of 1-[2-methoxyethyl(methyl)amino]-2-(sulfamoylamino)ethane?
The IUPAC name of 1-[2-methoxyethyl(methyl)amino]-2-(sulfamoylamino)ethane (CID 112689073) is 1-[2-methoxyethyl(methyl)amino]-2-(sulfamoylamino)ethane.
What is the SMILES notation for 1-[2-methoxyethyl(methyl)amino]-2-(sulfamoylamino)ethane?
The canonical SMILES for 1-[2-methoxyethyl(methyl)amino]-2-(sulfamoylamino)ethane is COCCN(C)CCNS(N)(=O)=O.
What is the InChIKey of 1-[2-methoxyethyl(methyl)amino]-2-(sulfamoylamino)ethane?
The InChIKey is PGVRMEZTVDAUND-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H17N3O3S/c1-9(5-6-12-2)4-3-8-13(7,10)11/h8H,3-6H2,1-2H3,(H2,7,10,11).
What are the key properties of 1-[2-methoxyethyl(methyl)amino]-2-(sulfamoylamino)ethane?
1-[2-methoxyethyl(methyl)amino]-2-(sulfamoylamino)ethane has a molecular weight of 211.29 g/mol, XLogP of -1.64, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-methoxyethyl(methyl)amino]-2-(sulfamoylamino)ethane is sourced from PubChem (CID 112689073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).