2-(cyclopentylsulfonylamino)-N'-hydroxycyclopentane-1-carboximidamide

C11H21N3O3S — CID 105361615

IUPAC2-(cyclopentylsulfonylamino)-N'-hydroxycyclopentane-1-carboximidamide
SMILESNC(=NO)C1CCCC1NS(=O)(=O)C1CCCC1
InChIInChI=1S/C11H21N3O3S/c12-11(13-15)9-6-3-7-10(9)14-18(16,17)8-4-1-2-5-8/h8-10,14-15H,1-7H2,(H2,12,13)
InChIKeyKUAVFKDEQANMPL-UHFFFAOYSA-N
MW275.37 g/mol
LogP0.76
Rot. Bonds4

About 2-(cyclopentylsulfonylamino)-N'-hydroxycyclopentane-1-carboximidamide

2-(cyclopentylsulfonylamino)-N'-hydroxycyclopentane-1-carboximidamide (PubChem CID 105361615) has the molecular formula C11H21N3O3S and a molecular weight of 275.37 g/mol. Its IUPAC name is 2-(cyclopentylsulfonylamino)-N'-hydroxycyclopentane-1-carboximidamide.

Molecular Properties

Compound Name2-(cyclopentylsulfonylamino)-N'-hydroxycyclopentane-1-carboximidamide
PubChem CID105361615
Molecular FormulaC11H21N3O3S
Molecular Weight275.37 g/mol
Exact Mass275.13
IUPAC Name2-(cyclopentylsulfonylamino)-N'-hydroxycyclopentane-1-carboximidamide
SMILESNC(=NO)C1CCCC1NS(=O)(=O)C1CCCC1
InChIInChI=1S/C11H21N3O3S/c12-11(13-15)9-6-3-7-10(9)14-18(16,17)8-4-1-2-5-8/h8-10,14-15H,1-7H2,(H2,12,13)
InChIKeyKUAVFKDEQANMPL-UHFFFAOYSA-N
XLogP0.76
TPSA104.78 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.37
LogP ≤ 50.76
H-Bond Donors ≤ 53
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'}

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Related Compounds

N'-hydroxy-2-(sulfamoylamino)cyclopentane-1-carboximidamide
CID 104985778
2-(ethylsulfonylamino)-N'-hydroxycyclopentane-1-carboximidamide
CID 76978993
2-(cyclopropylsulfonylamino)cyclopentane-1-carbothioamide
CID 64553686
N'-hydroxy-2-(propylsulfonylamino)cyclopentane-1-carboximidamide
CID 76978990
N'-hydroxy-2-[(2-methylpiperidin-1-yl)sulfonylamino]cyclopentane-1-carboximidamide
CID 76978346
[2-[(E)-N'-hydroxycarbamimidoyl]cyclohexyl]carbamic acid
CID 138597727
2-[(2-fluorophenyl)sulfonylamino]-N'-hydroxycyclopentane-1-carboximidamide
CID 76978995
N-[2-(N'-hydroxycarbamimidoyl)cyclopentyl]-2-methylsulfonylacetamide
CID 77015041
N'-hydroxy-2-[(2-methyl-1,3-thiazol-5-yl)sulfonylamino]cyclopentane-1-carboximidamide
CID 103415692
2-[(5-ethylthiophen-2-yl)sulfonylamino]-N'-hydroxycyclopentane-1-carboximidamide
CID 76978334
N-[2-(hydroxymethyl)cyclopentyl]cyclopropanesulfonamide
CID 103835909
2-[(5-fluoro-2-methylphenyl)sulfonylamino]-N'-hydroxycyclopentane-1-carboximidamide
CID 76978973

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopentylsulfonylamino)-N'-hydroxycyclopentane-1-carboximidamide?
The IUPAC name of 2-(cyclopentylsulfonylamino)-N'-hydroxycyclopentane-1-carboximidamide (CID 105361615) is 2-(cyclopentylsulfonylamino)-N'-hydroxycyclopentane-1-carboximidamide.
What is the SMILES notation for 2-(cyclopentylsulfonylamino)-N'-hydroxycyclopentane-1-carboximidamide?
The canonical SMILES for 2-(cyclopentylsulfonylamino)-N'-hydroxycyclopentane-1-carboximidamide is NC(=NO)C1CCCC1NS(=O)(=O)C1CCCC1.
What is the InChIKey of 2-(cyclopentylsulfonylamino)-N'-hydroxycyclopentane-1-carboximidamide?
The InChIKey is KUAVFKDEQANMPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O3S/c12-11(13-15)9-6-3-7-10(9)14-18(16,17)8-4-1-2-5-8/h8-10,14-15H,1-7H2,(H2,12,13).
What are the key properties of 2-(cyclopentylsulfonylamino)-N'-hydroxycyclopentane-1-carboximidamide?
2-(cyclopentylsulfonylamino)-N'-hydroxycyclopentane-1-carboximidamide has a molecular weight of 275.37 g/mol, XLogP of 0.76, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopentylsulfonylamino)-N'-hydroxycyclopentane-1-carboximidamide is sourced from PubChem (CID 105361615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).