2-(2-methoxyethylsulfamoylamino)ethanesulfonamide

C5H15N3O5S2 — CID 114816615

IUPAC2-(2-methoxyethylsulfamoylamino)ethanesulfonamide
SMILESCOCCNS(=O)(=O)NCCS(N)(=O)=O
InChIInChI=1S/C5H15N3O5S2/c1-13-4-2-7-15(11,12)8-3-5-14(6,9)10/h7-8H,2-5H2,1H3,(H2,6,9,10)
InChIKeyDWCLCYZFSFUSOU-UHFFFAOYSA-N
MW261.32 g/mol
LogP-2.65
Rot. Bonds8

About 2-(2-methoxyethylsulfamoylamino)ethanesulfonamide

2-(2-methoxyethylsulfamoylamino)ethanesulfonamide (PubChem CID 114816615) has the molecular formula C5H15N3O5S2 and a molecular weight of 261.32 g/mol. Its IUPAC name is 2-(2-methoxyethylsulfamoylamino)ethanesulfonamide.

Molecular Properties

Compound Name2-(2-methoxyethylsulfamoylamino)ethanesulfonamide
PubChem CID114816615
Molecular FormulaC5H15N3O5S2
Molecular Weight261.32 g/mol
Exact Mass261.05
IUPAC Name2-(2-methoxyethylsulfamoylamino)ethanesulfonamide
SMILESCOCCNS(=O)(=O)NCCS(N)(=O)=O
InChIInChI=1S/C5H15N3O5S2/c1-13-4-2-7-15(11,12)8-3-5-14(6,9)10/h7-8H,2-5H2,1H3,(H2,6,9,10)
InChIKeyDWCLCYZFSFUSOU-UHFFFAOYSA-N
XLogP-2.65
TPSA127.59 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 5-2.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-methoxyethanesulfonamide;hydrofluoride
CID 18951505
1-N-(2-methoxyethylsulfamoyl)butane-1,2-diamine
CID 114816081
N'-hydroxy-2-(2-methoxyethylsulfamoylamino)ethanimidamide
CID 104978766
3-methoxypropane-1-sulfonamide
CID 22737399
4-[2-(2-methoxyethylsulfamoylamino)ethyl]benzenesulfonamide
CID 114816625
2-(2-methoxyethylamino)-N-(2-sulfamoylethyl)acetamide
CID 79281474
N'-(2-methoxyethylsulfamoyl)-2-methylpentane-1,5-diamine
CID 106154148
N-[[1-(aminomethyl)cyclopropyl]methylsulfamoyl]-2-methoxyethanamine
CID 114816777
N-(2-methoxyethylsulfamoyl)pent-4-yn-1-amine
CID 106223265
N-(2-methoxyethyl)sulfamoyl chloride
CID 22326608
1-(2-methoxyethylsulfamoylamino)-3,3-dimethylbutan-2-one
CID 114815341
methyl 2-(2-methoxyethylsulfamoylamino)propanoate
CID 114816323

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethylsulfamoylamino)ethanesulfonamide?
The IUPAC name of 2-(2-methoxyethylsulfamoylamino)ethanesulfonamide (CID 114816615) is 2-(2-methoxyethylsulfamoylamino)ethanesulfonamide.
What is the SMILES notation for 2-(2-methoxyethylsulfamoylamino)ethanesulfonamide?
The canonical SMILES for 2-(2-methoxyethylsulfamoylamino)ethanesulfonamide is COCCNS(=O)(=O)NCCS(N)(=O)=O.
What is the InChIKey of 2-(2-methoxyethylsulfamoylamino)ethanesulfonamide?
The InChIKey is DWCLCYZFSFUSOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H15N3O5S2/c1-13-4-2-7-15(11,12)8-3-5-14(6,9)10/h7-8H,2-5H2,1H3,(H2,6,9,10).
What are the key properties of 2-(2-methoxyethylsulfamoylamino)ethanesulfonamide?
2-(2-methoxyethylsulfamoylamino)ethanesulfonamide has a molecular weight of 261.32 g/mol, XLogP of -2.65, 8 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethylsulfamoylamino)ethanesulfonamide is sourced from PubChem (CID 114816615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).