2-[ethyl(2-methoxyethylsulfamoyl)amino]ethanimidamide

C7H18N4O3S — CID 114816876

IUPAC2-[ethyl(2-methoxyethylsulfamoyl)amino]ethanimidamide
SMILES[H]/N=C(\N)CN(CC)S(=O)(=O)NCCOC
InChIInChI=1S/C7H18N4O3S/c1-3-11(6-7(8)9)15(12,13)10-4-5-14-2/h10H,3-6H2,1-2H3,(H3,8,9)
InChIKeyNLACRAWMWNXBRJ-UHFFFAOYSA-N
MW238.31 g/mol
LogP-1.27
Rot. Bonds8

About 2-[ethyl(2-methoxyethylsulfamoyl)amino]ethanimidamide

2-[ethyl(2-methoxyethylsulfamoyl)amino]ethanimidamide (PubChem CID 114816876) has the molecular formula C7H18N4O3S and a molecular weight of 238.31 g/mol. Its IUPAC name is 2-[ethyl(2-methoxyethylsulfamoyl)amino]ethanimidamide.

Molecular Properties

Compound Name2-[ethyl(2-methoxyethylsulfamoyl)amino]ethanimidamide
PubChem CID114816876
Molecular FormulaC7H18N4O3S
Molecular Weight238.31 g/mol
Exact Mass238.11
IUPAC Name2-[ethyl(2-methoxyethylsulfamoyl)amino]ethanimidamide
SMILES[H]/N=C(\N)CN(CC)S(=O)(=O)NCCOC
InChIInChI=1S/C7H18N4O3S/c1-3-11(6-7(8)9)15(12,13)10-4-5-14-2/h10H,3-6H2,1-2H3,(H3,8,9)
InChIKeyNLACRAWMWNXBRJ-UHFFFAOYSA-N
XLogP-1.27
TPSA108.51 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.31
LogP ≤ 5-1.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

1-amino-2-[ethyl(2-methoxyethylsulfamoyl)amino]ethane
CID 114813872
2-[methyl(propylsulfamoyl)amino]ethanimidamide
CID 114813264
ethyl 2-[2-methoxyethylsulfamoyl(propyl)amino]acetate
CID 114816314
2-[ethyl(2-propan-2-yloxyethylsulfonyl)amino]ethanimidamide
CID 79600077
methyl 2-[ethyl(propylsulfamoyl)amino]acetate
CID 114811544
2-[ethylsulfamoyl(propan-2-yl)amino]ethanimidamide
CID 114813558
3-[cyclopropylsulfamoyl(2-methoxyethyl)amino]propanimidamide
CID 114813460
2-[propyl(sulfamoyl)amino]ethanimidamide
CID 114959687
2-[2-methoxyethyl(methyl)amino]ethanimidamide
CID 61427043
ethyl 2-[ethyl(ethylsulfamoyl)amino]acetate
CID 115638420
3-[2-methoxyethyl(methylsulfonylmethylsulfonyl)amino]propanimidamide
CID 82842993
methyl 3-(diethylsulfamoylamino)propanoate
CID 60713707

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl(2-methoxyethylsulfamoyl)amino]ethanimidamide?
The IUPAC name of 2-[ethyl(2-methoxyethylsulfamoyl)amino]ethanimidamide (CID 114816876) is 2-[ethyl(2-methoxyethylsulfamoyl)amino]ethanimidamide.
What is the SMILES notation for 2-[ethyl(2-methoxyethylsulfamoyl)amino]ethanimidamide?
The canonical SMILES for 2-[ethyl(2-methoxyethylsulfamoyl)amino]ethanimidamide is [H]/N=C(\N)CN(CC)S(=O)(=O)NCCOC.
What is the InChIKey of 2-[ethyl(2-methoxyethylsulfamoyl)amino]ethanimidamide?
The InChIKey is NLACRAWMWNXBRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18N4O3S/c1-3-11(6-7(8)9)15(12,13)10-4-5-14-2/h10H,3-6H2,1-2H3,(H3,8,9).
What are the key properties of 2-[ethyl(2-methoxyethylsulfamoyl)amino]ethanimidamide?
2-[ethyl(2-methoxyethylsulfamoyl)amino]ethanimidamide has a molecular weight of 238.31 g/mol, XLogP of -1.27, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl(2-methoxyethylsulfamoyl)amino]ethanimidamide is sourced from PubChem (CID 114816876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).