1,3-oxazolidin-2-ylidene(sulfanylidene)-λ4-sulfane

Name: 1,3-oxazolidin-2-ylidene(sulfanylidene)-λ4-sulfane — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₃H₅NOS₂ — CID 150988711

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC1,3-oxazolidin-2-ylidene(sulfanylidene)-λ4-sulfane

SMILESS=S=C1NCCO1

InChIInChI=1S/C3H5NOS2/c6-7-3-4-1-2-5-3/h4H,1-2H2

InChIKeyLRQLOUHNPHFXIE-UHFFFAOYSA-N

MW135.21 g/mol

LogP-0.76

Rot. Bonds

About 1,3-oxazolidin-2-ylidene(sulfanylidene)-λ4-sulfane

1,3-oxazolidin-2-ylidene(sulfanylidene)-λ4-sulfane (PubChem CID 150988711) has the molecular formula C₃H₅NOS₂ and a molecular weight of 135.21 g/mol. Its IUPAC name is 1,3-oxazolidin-2-ylidene(sulfanylidene)-λ4-sulfane.

Molecular Properties

Compound Name	1,3-oxazolidin-2-ylidene(sulfanylidene)-λ4-sulfane
PubChem CID	150988711
Molecular Formula	C₃H₅NOS₂
Molecular Weight	135.21 g/mol
Exact Mass	134.98
IUPAC Name	1,3-oxazolidin-2-ylidene(sulfanylidene)-λ4-sulfane
SMILES	S=S=C1NCCO1
InChI	InChI=1S/C3H5NOS2/c6-7-3-4-1-2-5-3/h4H,1-2H2
InChIKey	LRQLOUHNPHFXIE-UHFFFAOYSA-N
XLogP	-0.76
TPSA	21.26 Å²
H-Bond Donors	1
H-Bond Acceptors	2
Rotatable Bonds
Heavy Atoms	7
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	135.21
LogP ≤ 5	-0.76
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	2

Computed Properties (RDKit)

Structural Alerts	{'alert_name': 'Thiocarbonyl_group', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1,3-oxazolidin-2-ylidene(sulfanylidene)-λ4-sulfane?

The IUPAC name of 1,3-oxazolidin-2-ylidene(sulfanylidene)-λ4-sulfane (CID 150988711) is 1,3-oxazolidin-2-ylidene(sulfanylidene)-λ4-sulfane.

What is the SMILES notation for 1,3-oxazolidin-2-ylidene(sulfanylidene)-λ4-sulfane?

The canonical SMILES for 1,3-oxazolidin-2-ylidene(sulfanylidene)-λ4-sulfane is S=S=C1NCCO1.

What is the InChIKey of 1,3-oxazolidin-2-ylidene(sulfanylidene)-λ4-sulfane?

The InChIKey is LRQLOUHNPHFXIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H5NOS2/c6-7-3-4-1-2-5-3/h4H,1-2H2.

What are the key properties of 1,3-oxazolidin-2-ylidene(sulfanylidene)-λ4-sulfane?

1,3-oxazolidin-2-ylidene(sulfanylidene)-λ4-sulfane has a molecular weight of 135.21 g/mol, XLogP of -0.76, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for 1,3-oxazolidin-2-ylidene(sulfanylidene)-λ4-sulfane is sourced from PubChem (CID 150988711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 150988711 — identifiers, structure, computed properties (public domain)

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