4-[fluoro(methyl)amino]-N,N-dimethylpiperidine-1-sulfonamide

C8H18FN3O2S — CID 142926906

IUPAC4-[fluoro(methyl)amino]-N,N-dimethylpiperidine-1-sulfonamide
SMILESCN(F)C1CCN(S(=O)(=O)N(C)C)CC1
InChIInChI=1S/C8H18FN3O2S/c1-10(2)15(13,14)12-6-4-8(5-7-12)11(3)9/h8H,4-7H2,1-3H3
InChIKeyLKKWICCHONXXJM-UHFFFAOYSA-N
MW239.32 g/mol
LogP0.07
Rot. Bonds3

About 4-[fluoro(methyl)amino]-N,N-dimethylpiperidine-1-sulfonamide

4-[fluoro(methyl)amino]-N,N-dimethylpiperidine-1-sulfonamide (PubChem CID 142926906) has the molecular formula C8H18FN3O2S and a molecular weight of 239.32 g/mol. Its IUPAC name is 4-[fluoro(methyl)amino]-N,N-dimethylpiperidine-1-sulfonamide.

Molecular Properties

Compound Name4-[fluoro(methyl)amino]-N,N-dimethylpiperidine-1-sulfonamide
PubChem CID142926906
Molecular FormulaC8H18FN3O2S
Molecular Weight239.32 g/mol
Exact Mass239.11
IUPAC Name4-[fluoro(methyl)amino]-N,N-dimethylpiperidine-1-sulfonamide
SMILESCN(F)C1CCN(S(=O)(=O)N(C)C)CC1
InChIInChI=1S/C8H18FN3O2S/c1-10(2)15(13,14)12-6-4-8(5-7-12)11(3)9/h8H,4-7H2,1-3H3
InChIKeyLKKWICCHONXXJM-UHFFFAOYSA-N
XLogP0.07
TPSA43.86 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 50.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-halo', 'substructure': 'N/A'}

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Related Compounds

[(2-Ethylpiperidyl)sulfonyl]dimethylamine
CID 4465411
n,n,2-Trimethylpiperidine-1-sulfonamide
CID 223612
4-(Dimethylamino)piperidine-1-sulfonyl fluoride
CID 135564446
n,n-Dibutylpiperidine-1-sulfonamide
CID 224600
Dimethyl[methyl(1-methylpiperidin-4-YL)sulfamoyl]amine
CID 1943917
4-(Dimethylamino)piperidine-1-sulfonamide
CID 23627342
N-methyl-N-(1-methylpiperidin-4-yl)sulfamide
CID 43132025
N-butyl-N-methylpiperidine-1-sulfonamide
CID 52559151
4-[Cyclopropyl(sulfamoyl)amino]-1-methylpiperidine
CID 53629315
4-[Butyl(methyl)amino]piperidine-1-sulfonamide
CID 58602989
4-[Butyl(methyl)amino]piperidine-1-sulfonamide
CID 58602990
1-Ethyl-4-[methyl(sulfinato)amino]piperidine
CID 59098127

Frequently Asked Questions

What is the IUPAC name of 4-[fluoro(methyl)amino]-N,N-dimethylpiperidine-1-sulfonamide?
The IUPAC name of 4-[fluoro(methyl)amino]-N,N-dimethylpiperidine-1-sulfonamide (CID 142926906) is 4-[fluoro(methyl)amino]-N,N-dimethylpiperidine-1-sulfonamide.
What is the SMILES notation for 4-[fluoro(methyl)amino]-N,N-dimethylpiperidine-1-sulfonamide?
The canonical SMILES for 4-[fluoro(methyl)amino]-N,N-dimethylpiperidine-1-sulfonamide is CN(F)C1CCN(S(=O)(=O)N(C)C)CC1.
What is the InChIKey of 4-[fluoro(methyl)amino]-N,N-dimethylpiperidine-1-sulfonamide?
The InChIKey is LKKWICCHONXXJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18FN3O2S/c1-10(2)15(13,14)12-6-4-8(5-7-12)11(3)9/h8H,4-7H2,1-3H3.
What are the key properties of 4-[fluoro(methyl)amino]-N,N-dimethylpiperidine-1-sulfonamide?
4-[fluoro(methyl)amino]-N,N-dimethylpiperidine-1-sulfonamide has a molecular weight of 239.32 g/mol, XLogP of 0.07, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[fluoro(methyl)amino]-N,N-dimethylpiperidine-1-sulfonamide is sourced from PubChem (CID 142926906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).