2-[cyclopentylsulfonyl(methyl)amino]ethanimidamide

C8H17N3O2S — CID 105361938

IUPAC2-[cyclopentylsulfonyl(methyl)amino]ethanimidamide
SMILES[H]/N=C(\N)CN(C)S(=O)(=O)C1CCCC1
InChIInChI=1S/C8H17N3O2S/c1-11(6-8(9)10)14(12,13)7-4-2-3-5-7/h7H,2-6H2,1H3,(H3,9,10)
InChIKeyZBQUXDZPNVLJEM-UHFFFAOYSA-N
MW219.31 g/mol
LogP0.13
Rot. Bonds4

About 2-[cyclopentylsulfonyl(methyl)amino]ethanimidamide

2-[cyclopentylsulfonyl(methyl)amino]ethanimidamide (PubChem CID 105361938) has the molecular formula C8H17N3O2S and a molecular weight of 219.31 g/mol. Its IUPAC name is 2-[cyclopentylsulfonyl(methyl)amino]ethanimidamide.

Molecular Properties

Compound Name2-[cyclopentylsulfonyl(methyl)amino]ethanimidamide
PubChem CID105361938
Molecular FormulaC8H17N3O2S
Molecular Weight219.31 g/mol
Exact Mass219.10
IUPAC Name2-[cyclopentylsulfonyl(methyl)amino]ethanimidamide
SMILES[H]/N=C(\N)CN(C)S(=O)(=O)C1CCCC1
InChIInChI=1S/C8H17N3O2S/c1-11(6-8(9)10)14(12,13)7-4-2-3-5-7/h7H,2-6H2,1H3,(H3,9,10)
InChIKeyZBQUXDZPNVLJEM-UHFFFAOYSA-N
XLogP0.13
TPSA87.25 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.31
LogP ≤ 50.13
H-Bond Donors ≤ 52
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

N-(2-aminoethyl)-N-methylcyclopentanesulfonamide
CID 83701794
3-[cyclopentylsulfonyl(methyl)amino]-N'-hydroxypropanimidamide
CID 105361578
2-[(1,1-dioxothian-4-yl)-methylamino]ethanimidamide
CID 164654850
2-[methyl(propylsulfamoyl)amino]ethanimidamide
CID 114813264
N-(3-aminopropyl)-N-methylcyclohexanesulfonamide
CID 61065457
2-[cyclopentyl(3,3-dimethylbutylsulfonyl)amino]ethanimidamide
CID 103522003
N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)cyclopentanesulfonamide
CID 115752221
2-[methyl-(4-methylcycloheptyl)sulfonylamino]acetic acid
CID 142345030
2-[cyclopentylsulfonyl(ethyl)amino]-N'-hydroxyethanimidamide
CID 105361603
2-[hydroxy(methyl)amino]ethanimidamide
CID 87382268
1-(2-amino-2-iminoethyl)-1-cyclopentyl-3,3-diethylurea
CID 79161307
N-(2-amino-2-iminoethyl)-N,4-dimethylpiperidine-1-carboxamide
CID 79163420

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentylsulfonyl(methyl)amino]ethanimidamide?
The IUPAC name of 2-[cyclopentylsulfonyl(methyl)amino]ethanimidamide (CID 105361938) is 2-[cyclopentylsulfonyl(methyl)amino]ethanimidamide.
What is the SMILES notation for 2-[cyclopentylsulfonyl(methyl)amino]ethanimidamide?
The canonical SMILES for 2-[cyclopentylsulfonyl(methyl)amino]ethanimidamide is [H]/N=C(\N)CN(C)S(=O)(=O)C1CCCC1.
What is the InChIKey of 2-[cyclopentylsulfonyl(methyl)amino]ethanimidamide?
The InChIKey is ZBQUXDZPNVLJEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N3O2S/c1-11(6-8(9)10)14(12,13)7-4-2-3-5-7/h7H,2-6H2,1H3,(H3,9,10).
What are the key properties of 2-[cyclopentylsulfonyl(methyl)amino]ethanimidamide?
2-[cyclopentylsulfonyl(methyl)amino]ethanimidamide has a molecular weight of 219.31 g/mol, XLogP of 0.13, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopentylsulfonyl(methyl)amino]ethanimidamide is sourced from PubChem (CID 105361938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).