(2R)-N-methyl-2-(trifluoromethyl)pyrrolidine-1-sulfonamide

C6H11F3N2O2S — CID 129131172

IUPAC(2R)-N-methyl-2-(trifluoromethyl)pyrrolidine-1-sulfonamide
SMILESCNS(=O)(=O)N1CCC[C@@H]1C(F)(F)F
InChIInChI=1S/C6H11F3N2O2S/c1-10-14(12,13)11-4-2-3-5(11)6(7,8)9/h5,10H,2-4H2,1H3/t5-/m1/s1
InChIKeyQJRYAOQSLSDPEH-RXMQYKEDSA-N
MW232.23 g/mol
LogP0.48
Rot. Bonds2

About (2R)-N-methyl-2-(trifluoromethyl)pyrrolidine-1-sulfonamide

(2R)-N-methyl-2-(trifluoromethyl)pyrrolidine-1-sulfonamide (PubChem CID 129131172) has the molecular formula C6H11F3N2O2S and a molecular weight of 232.23 g/mol. Its IUPAC name is (2R)-N-methyl-2-(trifluoromethyl)pyrrolidine-1-sulfonamide.

Molecular Properties

Compound Name(2R)-N-methyl-2-(trifluoromethyl)pyrrolidine-1-sulfonamide
PubChem CID129131172
Molecular FormulaC6H11F3N2O2S
Molecular Weight232.23 g/mol
Exact Mass232.05
IUPAC Name(2R)-N-methyl-2-(trifluoromethyl)pyrrolidine-1-sulfonamide
SMILESCNS(=O)(=O)N1CCC[C@@H]1C(F)(F)F
InChIInChI=1S/C6H11F3N2O2S/c1-10-14(12,13)11-4-2-3-5(11)6(7,8)9/h5,10H,2-4H2,1H3/t5-/m1/s1
InChIKeyQJRYAOQSLSDPEH-RXMQYKEDSA-N
XLogP0.48
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.23
LogP ≤ 50.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R)-N-methyl-2-(trifluoromethyl)pyrrolidine-1-sulfonamide?
The IUPAC name of (2R)-N-methyl-2-(trifluoromethyl)pyrrolidine-1-sulfonamide (CID 129131172) is (2R)-N-methyl-2-(trifluoromethyl)pyrrolidine-1-sulfonamide.
What is the SMILES notation for (2R)-N-methyl-2-(trifluoromethyl)pyrrolidine-1-sulfonamide?
The canonical SMILES for (2R)-N-methyl-2-(trifluoromethyl)pyrrolidine-1-sulfonamide is CNS(=O)(=O)N1CCC[C@@H]1C(F)(F)F.
What is the InChIKey of (2R)-N-methyl-2-(trifluoromethyl)pyrrolidine-1-sulfonamide?
The InChIKey is QJRYAOQSLSDPEH-RXMQYKEDSA-N. The full InChI is InChI=1S/C6H11F3N2O2S/c1-10-14(12,13)11-4-2-3-5(11)6(7,8)9/h5,10H,2-4H2,1H3/t5-/m1/s1.
What are the key properties of (2R)-N-methyl-2-(trifluoromethyl)pyrrolidine-1-sulfonamide?
(2R)-N-methyl-2-(trifluoromethyl)pyrrolidine-1-sulfonamide has a molecular weight of 232.23 g/mol, XLogP of 0.48, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-methyl-2-(trifluoromethyl)pyrrolidine-1-sulfonamide is sourced from PubChem (CID 129131172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).