1-(ethylsulfamoylamino)-N'-hydroxycyclooctane-1-carboximidamide

C11H24N4O3S — CID 104978303

IUPAC1-(ethylsulfamoylamino)-N'-hydroxycyclooctane-1-carboximidamide
SMILESCCNS(=O)(=O)NC1(C(N)=NO)CCCCCCC1
InChIInChI=1S/C11H24N4O3S/c1-2-13-19(17,18)15-11(10(12)14-16)8-6-4-3-5-7-9-11/h13,15-16H,2-9H2,1H3,(H2,12,14)
InChIKeyILNWOCOEJUDUEV-UHFFFAOYSA-N
MW292.40 g/mol
LogP0.66
Rot. Bonds5

About 1-(ethylsulfamoylamino)-N'-hydroxycyclooctane-1-carboximidamide

1-(ethylsulfamoylamino)-N'-hydroxycyclooctane-1-carboximidamide (PubChem CID 104978303) has the molecular formula C11H24N4O3S and a molecular weight of 292.40 g/mol. Its IUPAC name is 1-(ethylsulfamoylamino)-N'-hydroxycyclooctane-1-carboximidamide.

Molecular Properties

Compound Name1-(ethylsulfamoylamino)-N'-hydroxycyclooctane-1-carboximidamide
PubChem CID104978303
Molecular FormulaC11H24N4O3S
Molecular Weight292.40 g/mol
Exact Mass292.16
IUPAC Name1-(ethylsulfamoylamino)-N'-hydroxycyclooctane-1-carboximidamide
SMILESCCNS(=O)(=O)NC1(C(N)=NO)CCCCCCC1
InChIInChI=1S/C11H24N4O3S/c1-2-13-19(17,18)15-11(10(12)14-16)8-6-4-3-5-7-9-11/h13,15-16H,2-9H2,1H3,(H2,12,14)
InChIKeyILNWOCOEJUDUEV-UHFFFAOYSA-N
XLogP0.66
TPSA116.81 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.40
LogP ≤ 50.66
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'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'}

Analyze 1-(ethylsulfamoylamino)-N'-hydroxycyclooctane-1-carboximidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(Diethylsulfamoylamino)cyclooctane-1-carboximidamide
CID 64406318
1-(Dimethylsulfamoylamino)cyclooctane-1-carboximidamide
CID 64406949
1-[[Methyl(propan-2-yl)sulfamoyl]amino]cyclooctane-1-carboximidamide
CID 64407160
N'-hydroxy-1-[[methyl(propan-2-yl)sulfamoyl]amino]cyclooctane-1-carboximidamide
CID 76904457
N'-hydroxy-1-[[methyl(propan-2-yl)sulfamoyl]amino]cycloheptane-1-carboximidamide
CID 76904460
2-(tert-butylsulfamoylamino)-2-cyclohexyl-N'-hydroxyethanimidamide
CID 104978257
1-(cyclopropylsulfamoylamino)-N'-hydroxycyclooctane-1-carboximidamide
CID 104978299
N'-hydroxy-1-(methylsulfamoylamino)cyclooctane-1-carboximidamide
CID 104978300
1-(tert-butylsulfamoylamino)-N'-hydroxycyclooctane-1-carboximidamide
CID 104978301
N'-hydroxy-1-(propylsulfamoylamino)cyclooctane-1-carboximidamide
CID 104978302
N'-hydroxy-1-(propan-2-ylsulfamoylamino)cyclooctane-1-carboximidamide
CID 104978304
1-(ethylsulfamoylamino)-N'-hydroxycyclopentane-1-carboximidamide
CID 104978316

Frequently Asked Questions

What is the IUPAC name of 1-(ethylsulfamoylamino)-N'-hydroxycyclooctane-1-carboximidamide?
The IUPAC name of 1-(ethylsulfamoylamino)-N'-hydroxycyclooctane-1-carboximidamide (CID 104978303) is 1-(ethylsulfamoylamino)-N'-hydroxycyclooctane-1-carboximidamide.
What is the SMILES notation for 1-(ethylsulfamoylamino)-N'-hydroxycyclooctane-1-carboximidamide?
The canonical SMILES for 1-(ethylsulfamoylamino)-N'-hydroxycyclooctane-1-carboximidamide is CCNS(=O)(=O)NC1(C(N)=NO)CCCCCCC1.
What is the InChIKey of 1-(ethylsulfamoylamino)-N'-hydroxycyclooctane-1-carboximidamide?
The InChIKey is ILNWOCOEJUDUEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N4O3S/c1-2-13-19(17,18)15-11(10(12)14-16)8-6-4-3-5-7-9-11/h13,15-16H,2-9H2,1H3,(H2,12,14).
What are the key properties of 1-(ethylsulfamoylamino)-N'-hydroxycyclooctane-1-carboximidamide?
1-(ethylsulfamoylamino)-N'-hydroxycyclooctane-1-carboximidamide has a molecular weight of 292.40 g/mol, XLogP of 0.66, 5 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(ethylsulfamoylamino)-N'-hydroxycyclooctane-1-carboximidamide is sourced from PubChem (CID 104978303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).