1-(methylsulfamoylamino)cyclopentane-1-carboximidamide

C7H16N4O2S — CID 114813163

IUPAC1-(methylsulfamoylamino)cyclopentane-1-carboximidamide
SMILES[H]/N=C(\N)C1(NS(=O)(=O)NC)CCCC1
InChIInChI=1S/C7H16N4O2S/c1-10-14(12,13)11-7(6(8)9)4-2-3-5-7/h10-11H,2-5H2,1H3,(H3,8,9)
InChIKeyAEIHSVQURBVAEO-UHFFFAOYSA-N
MW220.30 g/mol
LogP-0.71
Rot. Bonds4

About 1-(methylsulfamoylamino)cyclopentane-1-carboximidamide

1-(methylsulfamoylamino)cyclopentane-1-carboximidamide (PubChem CID 114813163) has the molecular formula C7H16N4O2S and a molecular weight of 220.30 g/mol. Its IUPAC name is 1-(methylsulfamoylamino)cyclopentane-1-carboximidamide.

Molecular Properties

Compound Name1-(methylsulfamoylamino)cyclopentane-1-carboximidamide
PubChem CID114813163
Molecular FormulaC7H16N4O2S
Molecular Weight220.30 g/mol
Exact Mass220.10
IUPAC Name1-(methylsulfamoylamino)cyclopentane-1-carboximidamide
SMILES[H]/N=C(\N)C1(NS(=O)(=O)NC)CCCC1
InChIInChI=1S/C7H16N4O2S/c1-10-14(12,13)11-7(6(8)9)4-2-3-5-7/h10-11H,2-5H2,1H3,(H3,8,9)
InChIKeyAEIHSVQURBVAEO-UHFFFAOYSA-N
XLogP-0.71
TPSA108.07 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.30
LogP ≤ 5-0.71
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-(Diethylsulfamoylamino)cyclopentane-1-carboximidamide
CID 64406665
1-(Dimethylsulfamoylamino)cyclopentane-1-carboximidamide
CID 64407710
1-[[Methyl(propan-2-yl)sulfamoyl]amino]cyclopentane-1-carboximidamide
CID 64408750
4-Imino-2-thia-1,3-diazaspiro[4.4]nonane 2,2-dioxide
CID 91811072
N'-hydroxy-1-(methylsulfamoylamino)cyclopentane-1-carboximidamide
CID 104978313
1-(tert-butylsulfamoylamino)-N'-hydroxycyclopentane-1-carboximidamide
CID 104978314
1-(ethylsulfamoylamino)-N'-hydroxycyclopentane-1-carboximidamide
CID 104978316
N'-hydroxy-1-(propan-2-ylsulfamoylamino)cyclopentane-1-carboximidamide
CID 104978317
N'-hydroxy-1-(2-methylpropylsulfamoylamino)cyclopentane-1-carboximidamide
CID 104978767
N'-hydroxy-1-(propylsulfamoylamino)cyclopentane-1-carboximidamide
CID 113637610
1-(Tert-butylsulfamoylamino)cyclopentane-1-carboximidamide
CID 113637734
1-(Propan-2-ylsulfamoylamino)cyclopentane-1-carboximidamide
CID 114813161

Frequently Asked Questions

What is the IUPAC name of 1-(methylsulfamoylamino)cyclopentane-1-carboximidamide?
The IUPAC name of 1-(methylsulfamoylamino)cyclopentane-1-carboximidamide (CID 114813163) is 1-(methylsulfamoylamino)cyclopentane-1-carboximidamide.
What is the SMILES notation for 1-(methylsulfamoylamino)cyclopentane-1-carboximidamide?
The canonical SMILES for 1-(methylsulfamoylamino)cyclopentane-1-carboximidamide is [H]/N=C(\N)C1(NS(=O)(=O)NC)CCCC1.
What is the InChIKey of 1-(methylsulfamoylamino)cyclopentane-1-carboximidamide?
The InChIKey is AEIHSVQURBVAEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N4O2S/c1-10-14(12,13)11-7(6(8)9)4-2-3-5-7/h10-11H,2-5H2,1H3,(H3,8,9).
What are the key properties of 1-(methylsulfamoylamino)cyclopentane-1-carboximidamide?
1-(methylsulfamoylamino)cyclopentane-1-carboximidamide has a molecular weight of 220.30 g/mol, XLogP of -0.71, 4 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(methylsulfamoylamino)cyclopentane-1-carboximidamide is sourced from PubChem (CID 114813163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).