1-(oxolan-2-ylmethyl)azetidine-3-sulfonamide

C8H16N2O3S — CID 137403850

IUPAC1-(oxolan-2-ylmethyl)azetidine-3-sulfonamide
SMILESNS(=O)(=O)C1CN(CC2CCCO2)C1
InChIInChI=1S/C8H16N2O3S/c9-14(11,12)8-5-10(6-8)4-7-2-1-3-13-7/h7-8H,1-6H2,(H2,9,11,12)
InChIKeyMGWJVDRCXPWNQS-UHFFFAOYSA-N
MW220.29 g/mol
LogP-0.86
Rot. Bonds3

About 1-(oxolan-2-ylmethyl)azetidine-3-sulfonamide

1-(oxolan-2-ylmethyl)azetidine-3-sulfonamide (PubChem CID 137403850) has the molecular formula C8H16N2O3S and a molecular weight of 220.29 g/mol. Its IUPAC name is 1-(oxolan-2-ylmethyl)azetidine-3-sulfonamide.

Molecular Properties

Compound Name1-(oxolan-2-ylmethyl)azetidine-3-sulfonamide
PubChem CID137403850
Molecular FormulaC8H16N2O3S
Molecular Weight220.29 g/mol
Exact Mass220.09
IUPAC Name1-(oxolan-2-ylmethyl)azetidine-3-sulfonamide
SMILESNS(=O)(=O)C1CN(CC2CCCO2)C1
InChIInChI=1S/C8H16N2O3S/c9-14(11,12)8-5-10(6-8)4-7-2-1-3-13-7/h7-8H,1-6H2,(H2,9,11,12)
InChIKeyMGWJVDRCXPWNQS-UHFFFAOYSA-N
XLogP-0.86
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.29
LogP ≤ 5-0.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(oxolan-2-ylmethyl)azetidine-3-sulfonamide?
The IUPAC name of 1-(oxolan-2-ylmethyl)azetidine-3-sulfonamide (CID 137403850) is 1-(oxolan-2-ylmethyl)azetidine-3-sulfonamide.
What is the SMILES notation for 1-(oxolan-2-ylmethyl)azetidine-3-sulfonamide?
The canonical SMILES for 1-(oxolan-2-ylmethyl)azetidine-3-sulfonamide is NS(=O)(=O)C1CN(CC2CCCO2)C1.
What is the InChIKey of 1-(oxolan-2-ylmethyl)azetidine-3-sulfonamide?
The InChIKey is MGWJVDRCXPWNQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O3S/c9-14(11,12)8-5-10(6-8)4-7-2-1-3-13-7/h7-8H,1-6H2,(H2,9,11,12).
What are the key properties of 1-(oxolan-2-ylmethyl)azetidine-3-sulfonamide?
1-(oxolan-2-ylmethyl)azetidine-3-sulfonamide has a molecular weight of 220.29 g/mol, XLogP of -0.86, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(oxolan-2-ylmethyl)azetidine-3-sulfonamide is sourced from PubChem (CID 137403850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).