3-(methoxymethyl)pyrrolidine-1-sulfonamide

C6H14N2O3S — CID 64596834

IUPAC3-(methoxymethyl)pyrrolidine-1-sulfonamide
SMILESCOCC1CCN(S(N)(=O)=O)C1
InChIInChI=1S/C6H14N2O3S/c1-11-5-6-2-3-8(4-6)12(7,9)10/h6H,2-5H2,1H3,(H2,7,9,10)
InChIKeyZGHRHQYHGQDHPX-UHFFFAOYSA-N
MW194.26 g/mol
LogP-0.84
Rot. Bonds3

About 3-(methoxymethyl)pyrrolidine-1-sulfonamide

3-(methoxymethyl)pyrrolidine-1-sulfonamide (PubChem CID 64596834) has the molecular formula C6H14N2O3S and a molecular weight of 194.26 g/mol. Its IUPAC name is 3-(methoxymethyl)pyrrolidine-1-sulfonamide.

Molecular Properties

Compound Name3-(methoxymethyl)pyrrolidine-1-sulfonamide
PubChem CID64596834
Molecular FormulaC6H14N2O3S
Molecular Weight194.26 g/mol
Exact Mass194.07
IUPAC Name3-(methoxymethyl)pyrrolidine-1-sulfonamide
SMILESCOCC1CCN(S(N)(=O)=O)C1
InChIInChI=1S/C6H14N2O3S/c1-11-5-6-2-3-8(4-6)12(7,9)10/h6H,2-5H2,1H3,(H2,7,9,10)
InChIKeyZGHRHQYHGQDHPX-UHFFFAOYSA-N
XLogP-0.84
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.26
LogP ≤ 5-0.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(methoxymethyl)pyrrolidine-1-sulfonamide?
The IUPAC name of 3-(methoxymethyl)pyrrolidine-1-sulfonamide (CID 64596834) is 3-(methoxymethyl)pyrrolidine-1-sulfonamide.
What is the SMILES notation for 3-(methoxymethyl)pyrrolidine-1-sulfonamide?
The canonical SMILES for 3-(methoxymethyl)pyrrolidine-1-sulfonamide is COCC1CCN(S(N)(=O)=O)C1.
What is the InChIKey of 3-(methoxymethyl)pyrrolidine-1-sulfonamide?
The InChIKey is ZGHRHQYHGQDHPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O3S/c1-11-5-6-2-3-8(4-6)12(7,9)10/h6H,2-5H2,1H3,(H2,7,9,10).
What are the key properties of 3-(methoxymethyl)pyrrolidine-1-sulfonamide?
3-(methoxymethyl)pyrrolidine-1-sulfonamide has a molecular weight of 194.26 g/mol, XLogP of -0.84, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methoxymethyl)pyrrolidine-1-sulfonamide is sourced from PubChem (CID 64596834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).