N'-ethoxy-N'-(methanesulfonamido)methanesulfonohydrazide

C4H13N3O5S2 — CID 154447819

IUPACN'-ethoxy-N'-(methanesulfonamido)methanesulfonohydrazide
SMILESCCON(NS(C)(=O)=O)NS(C)(=O)=O
InChIInChI=1S/C4H13N3O5S2/c1-4-12-7(5-13(2,8)9)6-14(3,10)11/h5-6H,4H2,1-3H3
InChIKeyKOFNSYSZPXRXOS-UHFFFAOYSA-N
MW247.30 g/mol
LogP-1.83
Rot. Bonds6

About N'-ethoxy-N'-(methanesulfonamido)methanesulfonohydrazide

N'-ethoxy-N'-(methanesulfonamido)methanesulfonohydrazide (PubChem CID 154447819) has the molecular formula C4H13N3O5S2 and a molecular weight of 247.30 g/mol. Its IUPAC name is N'-ethoxy-N'-(methanesulfonamido)methanesulfonohydrazide.

Molecular Properties

Compound NameN'-ethoxy-N'-(methanesulfonamido)methanesulfonohydrazide
PubChem CID154447819
Molecular FormulaC4H13N3O5S2
Molecular Weight247.30 g/mol
Exact Mass247.03
IUPAC NameN'-ethoxy-N'-(methanesulfonamido)methanesulfonohydrazide
SMILESCCON(NS(C)(=O)=O)NS(C)(=O)=O
InChIInChI=1S/C4H13N3O5S2/c1-4-12-7(5-13(2,8)9)6-14(3,10)11/h5-6H,4H2,1-3H3
InChIKeyKOFNSYSZPXRXOS-UHFFFAOYSA-N
XLogP-1.83
TPSA104.81 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.30
LogP ≤ 5-1.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

N-ethoxy-N-(methylsulfonimidoyl)methanamine
CID 164656066
O-ethylhydroxylamine;methanesulfonic acid
CID 172739815
N,N,N',N'-tetraethoxyethane-1,2-diamine
CID 86169848
N-[1-[ethoxy(methylsulfonyl)amino]ethenyl]acetamide
CID 129202774
N-oxidomethanesulfonamide
CID 141093853
methanesulfonamide;propane
CID 158760342
N,N-diethoxymethanamine;methyl hydrogen sulfate
CID 173043351
diethylaminosulfamic acid
CID 87969127
ethane;methane;methanesulfonic acid;methoxyethane;propane
CID 160590924
dialuminum;ethoxyethane;trisulfate
CID 174817386
ethyl methanesulfonate;hydrofluoride
CID 174826290
disodium;ethoxyethane;sulfate
CID 158792070

Frequently Asked Questions

What is the IUPAC name of N'-ethoxy-N'-(methanesulfonamido)methanesulfonohydrazide?
The IUPAC name of N'-ethoxy-N'-(methanesulfonamido)methanesulfonohydrazide (CID 154447819) is N'-ethoxy-N'-(methanesulfonamido)methanesulfonohydrazide.
What is the SMILES notation for N'-ethoxy-N'-(methanesulfonamido)methanesulfonohydrazide?
The canonical SMILES for N'-ethoxy-N'-(methanesulfonamido)methanesulfonohydrazide is CCON(NS(C)(=O)=O)NS(C)(=O)=O.
What is the InChIKey of N'-ethoxy-N'-(methanesulfonamido)methanesulfonohydrazide?
The InChIKey is KOFNSYSZPXRXOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H13N3O5S2/c1-4-12-7(5-13(2,8)9)6-14(3,10)11/h5-6H,4H2,1-3H3.
What are the key properties of N'-ethoxy-N'-(methanesulfonamido)methanesulfonohydrazide?
N'-ethoxy-N'-(methanesulfonamido)methanesulfonohydrazide has a molecular weight of 247.30 g/mol, XLogP of -1.83, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethoxy-N'-(methanesulfonamido)methanesulfonohydrazide is sourced from PubChem (CID 154447819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).