oxane;thiane

C10H20OS — CID 67464677

IUPACoxane;thiane
SMILESC1CCOCC1.C1CCSCC1
InChIInChI=1S/C5H10O.C5H10S/c2*1-2-4-6-5-3-1/h2*1-5H2
InChIKeyAYNCZHAZMQYVGD-UHFFFAOYSA-N
MW188.34 g/mol
LogP3.09
Rot. Bonds

About oxane;thiane

oxane;thiane (PubChem CID 67464677) has the molecular formula C10H20OS and a molecular weight of 188.34 g/mol. Its IUPAC name is oxane;thiane.

Molecular Properties

Compound Nameoxane;thiane
PubChem CID67464677
Molecular FormulaC10H20OS
Molecular Weight188.34 g/mol
Exact Mass188.12
IUPAC Nameoxane;thiane
SMILESC1CCOCC1.C1CCSCC1
InChIInChI=1S/C5H10O.C5H10S/c2*1-2-4-6-5-3-1/h2*1-5H2
InChIKeyAYNCZHAZMQYVGD-UHFFFAOYSA-N
XLogP3.09
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.34
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of oxane;thiane?
The IUPAC name of oxane;thiane (CID 67464677) is oxane;thiane.
What is the SMILES notation for oxane;thiane?
The canonical SMILES for oxane;thiane is C1CCOCC1.C1CCSCC1.
What is the InChIKey of oxane;thiane?
The InChIKey is AYNCZHAZMQYVGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10O.C5H10S/c2*1-2-4-6-5-3-1/h2*1-5H2.
What are the key properties of oxane;thiane?
oxane;thiane has a molecular weight of 188.34 g/mol, XLogP of 3.09, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for oxane;thiane is sourced from PubChem (CID 67464677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).