oxolane-2-sulfinamide

C4H9NO2S — CID 86600399

IUPACoxolane-2-sulfinamide
SMILESNS(=O)C1CCCO1
InChIInChI=1S/C4H9NO2S/c5-8(6)4-2-1-3-7-4/h4H,1-3,5H2
InChIKeyBOBHRCAZWIREFO-UHFFFAOYSA-N
MW135.19 g/mol
LogP-0.25
Rot. Bonds1

About oxolane-2-sulfinamide

oxolane-2-sulfinamide (PubChem CID 86600399) has the molecular formula C4H9NO2S and a molecular weight of 135.19 g/mol. Its IUPAC name is oxolane-2-sulfinamide.

Molecular Properties

Compound Nameoxolane-2-sulfinamide
PubChem CID86600399
Molecular FormulaC4H9NO2S
Molecular Weight135.19 g/mol
Exact Mass135.04
IUPAC Nameoxolane-2-sulfinamide
SMILESNS(=O)C1CCCO1
InChIInChI=1S/C4H9NO2S/c5-8(6)4-2-1-3-7-4/h4H,1-3,5H2
InChIKeyBOBHRCAZWIREFO-UHFFFAOYSA-N
XLogP-0.25
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.19
LogP ≤ 5-0.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of oxolane-2-sulfinamide?
The IUPAC name of oxolane-2-sulfinamide (CID 86600399) is oxolane-2-sulfinamide.
What is the SMILES notation for oxolane-2-sulfinamide?
The canonical SMILES for oxolane-2-sulfinamide is NS(=O)C1CCCO1.
What is the InChIKey of oxolane-2-sulfinamide?
The InChIKey is BOBHRCAZWIREFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9NO2S/c5-8(6)4-2-1-3-7-4/h4H,1-3,5H2.
What are the key properties of oxolane-2-sulfinamide?
oxolane-2-sulfinamide has a molecular weight of 135.19 g/mol, XLogP of -0.25, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for oxolane-2-sulfinamide is sourced from PubChem (CID 86600399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).