2-(fluoromethyl)-N,N-dimethylpyrrolidine-1-sulfonamide

C7H15FN2O2S — CID 128512169

IUPAC2-(fluoromethyl)-N,N-dimethylpyrrolidine-1-sulfonamide
SMILESCN(C)S(=O)(=O)N1CCCC1CF
InChIInChI=1S/C7H15FN2O2S/c1-9(2)13(11,12)10-5-3-4-7(10)6-8/h7H,3-6H2,1-2H3
InChIKeyYDHRPZLLWRREDE-UHFFFAOYSA-N
MW210.27 g/mol
LogP0.23
Rot. Bonds3

About 2-(fluoromethyl)-N,N-dimethylpyrrolidine-1-sulfonamide

2-(fluoromethyl)-N,N-dimethylpyrrolidine-1-sulfonamide (PubChem CID 128512169) has the molecular formula C7H15FN2O2S and a molecular weight of 210.27 g/mol. Its IUPAC name is 2-(fluoromethyl)-N,N-dimethylpyrrolidine-1-sulfonamide.

Molecular Properties

Compound Name2-(fluoromethyl)-N,N-dimethylpyrrolidine-1-sulfonamide
PubChem CID128512169
Molecular FormulaC7H15FN2O2S
Molecular Weight210.27 g/mol
Exact Mass210.08
IUPAC Name2-(fluoromethyl)-N,N-dimethylpyrrolidine-1-sulfonamide
SMILESCN(C)S(=O)(=O)N1CCCC1CF
InChIInChI=1S/C7H15FN2O2S/c1-9(2)13(11,12)10-5-3-4-7(10)6-8/h7H,3-6H2,1-2H3
InChIKeyYDHRPZLLWRREDE-UHFFFAOYSA-N
XLogP0.23
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.27
LogP ≤ 50.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-Methylpyrrolidine-1-sulfonyl chloride
CID 60974846
(S)-2-methyl-1-((trifluoromethyl)sulfonyl)pyrrolidine
CID 86276438
(S)-2-Trifluoromethylpyrrolidine-1-sulfonamide
CID 66570523
(R)-2-(Trifluoromethyl)pyrrolidine-1-sulfonamide
CID 66570524
2-Trifluoromethylpyrrolidine-1-sulfonamide
CID 66570525
(2R)-N-methyl-2-(trifluoromethyl)pyrrolidine-1-sulfonamide
CID 129131172
2-Methyl-1-(trifluoromethylsulfonyl)pyrrolidine
CID 57341073
(2R)-2-(difluoromethyl)-N-methylpyrrolidine-1-sulfonamide
CID 130670104
2-(Fluoromethyl)pyrrolidine-1-sulfonamide
CID 130695804
2-(Fluoromethyl)-1-methylsulfonylpyrrolidine
CID 130736486
2-(fluoromethyl)-N-methylpyrrolidine-1-sulfonamide
CID 130743736
2-Methylpyrrolidine-1-sulfonamide
CID 60974052

Frequently Asked Questions

What is the IUPAC name of 2-(fluoromethyl)-N,N-dimethylpyrrolidine-1-sulfonamide?
The IUPAC name of 2-(fluoromethyl)-N,N-dimethylpyrrolidine-1-sulfonamide (CID 128512169) is 2-(fluoromethyl)-N,N-dimethylpyrrolidine-1-sulfonamide.
What is the SMILES notation for 2-(fluoromethyl)-N,N-dimethylpyrrolidine-1-sulfonamide?
The canonical SMILES for 2-(fluoromethyl)-N,N-dimethylpyrrolidine-1-sulfonamide is CN(C)S(=O)(=O)N1CCCC1CF.
What is the InChIKey of 2-(fluoromethyl)-N,N-dimethylpyrrolidine-1-sulfonamide?
The InChIKey is YDHRPZLLWRREDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15FN2O2S/c1-9(2)13(11,12)10-5-3-4-7(10)6-8/h7H,3-6H2,1-2H3.
What are the key properties of 2-(fluoromethyl)-N,N-dimethylpyrrolidine-1-sulfonamide?
2-(fluoromethyl)-N,N-dimethylpyrrolidine-1-sulfonamide has a molecular weight of 210.27 g/mol, XLogP of 0.23, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(fluoromethyl)-N,N-dimethylpyrrolidine-1-sulfonamide is sourced from PubChem (CID 128512169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).