2-[cyclopentyl(2-methoxyethylsulfamoyl)amino]-N'-hydroxyethanimidamide

C10H22N4O4S — CID 104978825

IUPAC2-[cyclopentyl(2-methoxyethylsulfamoyl)amino]-N'-hydroxyethanimidamide
SMILESCOCCNS(=O)(=O)N(CC(N)=NO)C1CCCC1
InChIInChI=1S/C10H22N4O4S/c1-18-7-6-12-19(16,17)14(8-10(11)13-15)9-4-2-3-5-9/h9,12,15H,2-8H2,1H3,(H2,11,13)
InChIKeyLYAHTBVROFOZOU-UHFFFAOYSA-N
MW294.38 g/mol
LogP-0.54
Rot. Bonds8

About 2-[cyclopentyl(2-methoxyethylsulfamoyl)amino]-N'-hydroxyethanimidamide

2-[cyclopentyl(2-methoxyethylsulfamoyl)amino]-N'-hydroxyethanimidamide (PubChem CID 104978825) has the molecular formula C10H22N4O4S and a molecular weight of 294.38 g/mol. Its IUPAC name is 2-[cyclopentyl(2-methoxyethylsulfamoyl)amino]-N'-hydroxyethanimidamide.

Molecular Properties

Compound Name2-[cyclopentyl(2-methoxyethylsulfamoyl)amino]-N'-hydroxyethanimidamide
PubChem CID104978825
Molecular FormulaC10H22N4O4S
Molecular Weight294.38 g/mol
Exact Mass294.14
IUPAC Name2-[cyclopentyl(2-methoxyethylsulfamoyl)amino]-N'-hydroxyethanimidamide
SMILESCOCCNS(=O)(=O)N(CC(N)=NO)C1CCCC1
InChIInChI=1S/C10H22N4O4S/c1-18-7-6-12-19(16,17)14(8-10(11)13-15)9-4-2-3-5-9/h9,12,15H,2-8H2,1H3,(H2,11,13)
InChIKeyLYAHTBVROFOZOU-UHFFFAOYSA-N
XLogP-0.54
TPSA117.25 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.38
LogP ≤ 5-0.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3-[cyclopropyl(2-methoxyethylsulfamoyl)amino]propanoic acid
CID 114814428
2-[cyclopentyl-[methyl(propan-2-yl)sulfamoyl]amino]-N'-hydroxyethanimidamide
CID 77038132
2-[cyclopentyl(piperidin-1-ylsulfonyl)amino]-N'-hydroxyethanimidamide
CID 77044834
2-[cyclopentyl-(4-methylpiperidin-1-yl)sulfonylamino]-N'-hydroxyethanimidamide
CID 77044621
2-[cyclopentyl(4-methoxybutyl)amino]-N'-hydroxyethanimidamide
CID 104647778
N'-hydroxy-2-(2-methoxyethylsulfamoylamino)ethanimidamide
CID 104978766
2-[cyclopentyl(ethylsulfamoyl)amino]ethanethioamide
CID 114808448
2-[cyclopentyl(methylsulfonyl)amino]-N-(2-methoxyethyl)acetamide
CID 113148836
2-[(1,1-dioxothiolan-3-yl)-(2-methoxyethylsulfamoyl)amino]acetic acid
CID 114814426
N'-hydroxy-3-[2-methoxyethyl(propylsulfamoyl)amino]propanimidamide
CID 104978456
2-[cyclohexyl(methyl)amino]-N'-hydroxyethanimidamide
CID 24706703
1-(2-amino-2-hydroxyiminoethyl)-3-butyl-1-cyclopentylurea
CID 77044727

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentyl(2-methoxyethylsulfamoyl)amino]-N'-hydroxyethanimidamide?
The IUPAC name of 2-[cyclopentyl(2-methoxyethylsulfamoyl)amino]-N'-hydroxyethanimidamide (CID 104978825) is 2-[cyclopentyl(2-methoxyethylsulfamoyl)amino]-N'-hydroxyethanimidamide.
What is the SMILES notation for 2-[cyclopentyl(2-methoxyethylsulfamoyl)amino]-N'-hydroxyethanimidamide?
The canonical SMILES for 2-[cyclopentyl(2-methoxyethylsulfamoyl)amino]-N'-hydroxyethanimidamide is COCCNS(=O)(=O)N(CC(N)=NO)C1CCCC1.
What is the InChIKey of 2-[cyclopentyl(2-methoxyethylsulfamoyl)amino]-N'-hydroxyethanimidamide?
The InChIKey is LYAHTBVROFOZOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N4O4S/c1-18-7-6-12-19(16,17)14(8-10(11)13-15)9-4-2-3-5-9/h9,12,15H,2-8H2,1H3,(H2,11,13).
What are the key properties of 2-[cyclopentyl(2-methoxyethylsulfamoyl)amino]-N'-hydroxyethanimidamide?
2-[cyclopentyl(2-methoxyethylsulfamoyl)amino]-N'-hydroxyethanimidamide has a molecular weight of 294.38 g/mol, XLogP of -0.54, 8 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopentyl(2-methoxyethylsulfamoyl)amino]-N'-hydroxyethanimidamide is sourced from PubChem (CID 104978825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).