sulfane;trimethylazanium;hydroxide

C3H13NOS — CID 158376156

IUPACsulfane;trimethylazanium;hydroxide
SMILESC[NH+](C)C.S.[OH-]
InChIInChI=1S/C3H9N.H2O.H2S/c1-4(2)3;;/h1-3H3;2*1H2
InChIKeyDLKFRKCTLPDFIX-UHFFFAOYSA-N
MW111.21 g/mol
LogP-1.30
Rot. Bonds

About sulfane;trimethylazanium;hydroxide

sulfane;trimethylazanium;hydroxide (PubChem CID 158376156) has the molecular formula C3H13NOS and a molecular weight of 111.21 g/mol. Its IUPAC name is sulfane;trimethylazanium;hydroxide.

Molecular Properties

Compound Namesulfane;trimethylazanium;hydroxide
PubChem CID158376156
Molecular FormulaC3H13NOS
Molecular Weight111.21 g/mol
Exact Mass111.07
IUPAC Namesulfane;trimethylazanium;hydroxide
SMILESC[NH+](C)C.S.[OH-]
InChIInChI=1S/C3H9N.H2O.H2S/c1-4(2)3;;/h1-3H3;2*1H2
InChIKeyDLKFRKCTLPDFIX-UHFFFAOYSA-N
XLogP-1.30
TPSA34.44 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500111.21
LogP ≤ 5-1.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of sulfane;trimethylazanium;hydroxide?
The IUPAC name of sulfane;trimethylazanium;hydroxide (CID 158376156) is sulfane;trimethylazanium;hydroxide.
What is the SMILES notation for sulfane;trimethylazanium;hydroxide?
The canonical SMILES for sulfane;trimethylazanium;hydroxide is C[NH+](C)C.S.[OH-].
What is the InChIKey of sulfane;trimethylazanium;hydroxide?
The InChIKey is DLKFRKCTLPDFIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H9N.H2O.H2S/c1-4(2)3;;/h1-3H3;2*1H2.
What are the key properties of sulfane;trimethylazanium;hydroxide?
sulfane;trimethylazanium;hydroxide has a molecular weight of 111.21 g/mol, XLogP of -1.30, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for sulfane;trimethylazanium;hydroxide is sourced from PubChem (CID 158376156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).