(3R)-N,N,3-trimethylpyrrolidine-1-sulfonamide

C7H16N2O2S — CID 130360221

IUPAC(3R)-N,N,3-trimethylpyrrolidine-1-sulfonamide
SMILESC[C@@H]1CCN(S(=O)(=O)N(C)C)C1
InChIInChI=1S/C7H16N2O2S/c1-7-4-5-9(6-7)12(10,11)8(2)3/h7H,4-6H2,1-3H3/t7-/m1/s1
InChIKeyXTKQZJRBGYQOLQ-SSDOTTSWSA-N
MW192.28 g/mol
LogP0.13
Rot. Bonds2

About (3R)-N,N,3-trimethylpyrrolidine-1-sulfonamide

(3R)-N,N,3-trimethylpyrrolidine-1-sulfonamide (PubChem CID 130360221) has the molecular formula C7H16N2O2S and a molecular weight of 192.28 g/mol. Its IUPAC name is (3R)-N,N,3-trimethylpyrrolidine-1-sulfonamide.

Molecular Properties

Compound Name(3R)-N,N,3-trimethylpyrrolidine-1-sulfonamide
PubChem CID130360221
Molecular FormulaC7H16N2O2S
Molecular Weight192.28 g/mol
Exact Mass192.09
IUPAC Name(3R)-N,N,3-trimethylpyrrolidine-1-sulfonamide
SMILESC[C@@H]1CCN(S(=O)(=O)N(C)C)C1
InChIInChI=1S/C7H16N2O2S/c1-7-4-5-9(6-7)12(10,11)8(2)3/h7H,4-6H2,1-3H3/t7-/m1/s1
InChIKeyXTKQZJRBGYQOLQ-SSDOTTSWSA-N
XLogP0.13
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.28
LogP ≤ 50.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3R)-N,N,3-trimethylpyrrolidine-1-sulfonamide?
The IUPAC name of (3R)-N,N,3-trimethylpyrrolidine-1-sulfonamide (CID 130360221) is (3R)-N,N,3-trimethylpyrrolidine-1-sulfonamide.
What is the SMILES notation for (3R)-N,N,3-trimethylpyrrolidine-1-sulfonamide?
The canonical SMILES for (3R)-N,N,3-trimethylpyrrolidine-1-sulfonamide is C[C@@H]1CCN(S(=O)(=O)N(C)C)C1.
What is the InChIKey of (3R)-N,N,3-trimethylpyrrolidine-1-sulfonamide?
The InChIKey is XTKQZJRBGYQOLQ-SSDOTTSWSA-N. The full InChI is InChI=1S/C7H16N2O2S/c1-7-4-5-9(6-7)12(10,11)8(2)3/h7H,4-6H2,1-3H3/t7-/m1/s1.
What are the key properties of (3R)-N,N,3-trimethylpyrrolidine-1-sulfonamide?
(3R)-N,N,3-trimethylpyrrolidine-1-sulfonamide has a molecular weight of 192.28 g/mol, XLogP of 0.13, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N,N,3-trimethylpyrrolidine-1-sulfonamide is sourced from PubChem (CID 130360221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).