methane;3-methoxypyrrolidine-1-sulfonamide

C6H16N2O3S — CID 177012106

IUPACmethane;3-methoxypyrrolidine-1-sulfonamide
SMILESC.COC1CCN(S(N)(=O)=O)C1
InChIInChI=1S/C5H12N2O3S.CH4/c1-10-5-2-3-7(4-5)11(6,8)9;/h5H,2-4H2,1H3,(H2,6,8,9);1H4
InChIKeyMEMNAXKCZLZHGX-UHFFFAOYSA-N
MW196.27 g/mol
LogP-0.45
Rot. Bonds2

About methane;3-methoxypyrrolidine-1-sulfonamide

methane;3-methoxypyrrolidine-1-sulfonamide (PubChem CID 177012106) has the molecular formula C6H16N2O3S and a molecular weight of 196.27 g/mol. Its IUPAC name is methane;3-methoxypyrrolidine-1-sulfonamide.

Molecular Properties

Compound Namemethane;3-methoxypyrrolidine-1-sulfonamide
PubChem CID177012106
Molecular FormulaC6H16N2O3S
Molecular Weight196.27 g/mol
Exact Mass196.09
IUPAC Namemethane;3-methoxypyrrolidine-1-sulfonamide
SMILESC.COC1CCN(S(N)(=O)=O)C1
InChIInChI=1S/C5H12N2O3S.CH4/c1-10-5-2-3-7(4-5)11(6,8)9;/h5H,2-4H2,1H3,(H2,6,8,9);1H4
InChIKeyMEMNAXKCZLZHGX-UHFFFAOYSA-N
XLogP-0.45
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.27
LogP ≤ 5-0.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of methane;3-methoxypyrrolidine-1-sulfonamide?
The IUPAC name of methane;3-methoxypyrrolidine-1-sulfonamide (CID 177012106) is methane;3-methoxypyrrolidine-1-sulfonamide.
What is the SMILES notation for methane;3-methoxypyrrolidine-1-sulfonamide?
The canonical SMILES for methane;3-methoxypyrrolidine-1-sulfonamide is C.COC1CCN(S(N)(=O)=O)C1.
What is the InChIKey of methane;3-methoxypyrrolidine-1-sulfonamide?
The InChIKey is MEMNAXKCZLZHGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2O3S.CH4/c1-10-5-2-3-7(4-5)11(6,8)9;/h5H,2-4H2,1H3,(H2,6,8,9);1H4.
What are the key properties of methane;3-methoxypyrrolidine-1-sulfonamide?
methane;3-methoxypyrrolidine-1-sulfonamide has a molecular weight of 196.27 g/mol, XLogP of -0.45, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methane;3-methoxypyrrolidine-1-sulfonamide is sourced from PubChem (CID 177012106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).