(3R)-3-methylpyrrolidine-1-sulfonamide

C5H12N2O2S — CID 174338471

IUPAC(3R)-3-methylpyrrolidine-1-sulfonamide
SMILESC[C@@H]1CCN(S(N)(=O)=O)C1
InChIInChI=1S/C5H12N2O2S/c1-5-2-3-7(4-5)10(6,8)9/h5H,2-4H2,1H3,(H2,6,8,9)/t5-/m1/s1
InChIKeySSWXHCGYJGPKJU-RXMQYKEDSA-N
MW164.23 g/mol
LogP-0.47
Rot. Bonds1

About (3R)-3-methylpyrrolidine-1-sulfonamide

(3R)-3-methylpyrrolidine-1-sulfonamide (PubChem CID 174338471) has the molecular formula C5H12N2O2S and a molecular weight of 164.23 g/mol. Its IUPAC name is (3R)-3-methylpyrrolidine-1-sulfonamide.

Molecular Properties

Compound Name(3R)-3-methylpyrrolidine-1-sulfonamide
PubChem CID174338471
Molecular FormulaC5H12N2O2S
Molecular Weight164.23 g/mol
Exact Mass164.06
IUPAC Name(3R)-3-methylpyrrolidine-1-sulfonamide
SMILESC[C@@H]1CCN(S(N)(=O)=O)C1
InChIInChI=1S/C5H12N2O2S/c1-5-2-3-7(4-5)10(6,8)9/h5H,2-4H2,1H3,(H2,6,8,9)/t5-/m1/s1
InChIKeySSWXHCGYJGPKJU-RXMQYKEDSA-N
XLogP-0.47
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.23
LogP ≤ 5-0.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3R)-3-methylpyrrolidine-1-sulfonamide?
The IUPAC name of (3R)-3-methylpyrrolidine-1-sulfonamide (CID 174338471) is (3R)-3-methylpyrrolidine-1-sulfonamide.
What is the SMILES notation for (3R)-3-methylpyrrolidine-1-sulfonamide?
The canonical SMILES for (3R)-3-methylpyrrolidine-1-sulfonamide is C[C@@H]1CCN(S(N)(=O)=O)C1.
What is the InChIKey of (3R)-3-methylpyrrolidine-1-sulfonamide?
The InChIKey is SSWXHCGYJGPKJU-RXMQYKEDSA-N. The full InChI is InChI=1S/C5H12N2O2S/c1-5-2-3-7(4-5)10(6,8)9/h5H,2-4H2,1H3,(H2,6,8,9)/t5-/m1/s1.
What are the key properties of (3R)-3-methylpyrrolidine-1-sulfonamide?
(3R)-3-methylpyrrolidine-1-sulfonamide has a molecular weight of 164.23 g/mol, XLogP of -0.47, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-methylpyrrolidine-1-sulfonamide is sourced from PubChem (CID 174338471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).