butane-2-sulfinamide

C4H11NOS — CID 54092182

IUPACbutane-2-sulfinamide
SMILESCCC(C)S(N)=O
InChIInChI=1S/C4H11NOS/c1-3-4(2)7(5)6/h4H,3,5H2,1-2H3
InChIKeyYOMWYEITAAOYEC-UHFFFAOYSA-N
MW121.20 g/mol
LogP0.41
Rot. Bonds2

About butane-2-sulfinamide

butane-2-sulfinamide (PubChem CID 54092182) has the molecular formula C4H11NOS and a molecular weight of 121.20 g/mol. Its IUPAC name is butane-2-sulfinamide.

Molecular Properties

Compound Namebutane-2-sulfinamide
PubChem CID54092182
Molecular FormulaC4H11NOS
Molecular Weight121.20 g/mol
Exact Mass121.06
IUPAC Namebutane-2-sulfinamide
SMILESCCC(C)S(N)=O
InChIInChI=1S/C4H11NOS/c1-3-4(2)7(5)6/h4H,3,5H2,1-2H3
InChIKeyYOMWYEITAAOYEC-UHFFFAOYSA-N
XLogP0.41
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500121.20
LogP ≤ 50.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of butane-2-sulfinamide?
The IUPAC name of butane-2-sulfinamide (CID 54092182) is butane-2-sulfinamide.
What is the SMILES notation for butane-2-sulfinamide?
The canonical SMILES for butane-2-sulfinamide is CCC(C)S(N)=O.
What is the InChIKey of butane-2-sulfinamide?
The InChIKey is YOMWYEITAAOYEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11NOS/c1-3-4(2)7(5)6/h4H,3,5H2,1-2H3.
What are the key properties of butane-2-sulfinamide?
butane-2-sulfinamide has a molecular weight of 121.20 g/mol, XLogP of 0.41, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for butane-2-sulfinamide is sourced from PubChem (CID 54092182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).