N-methyl-2-methylsulfinothioylethanamine

C4H11NS2 — CID 122502750

IUPACN-methyl-2-methylsulfinothioylethanamine
SMILESCNCCS(C)=S
InChIInChI=1S/C4H11NS2/c1-5-3-4-7(2)6/h5H,3-4H2,1-2H3
InChIKeyWYLNFJKNZLTJOU-UHFFFAOYSA-N
MW137.27 g/mol
LogP-0.08
Rot. Bonds3

About N-methyl-2-methylsulfinothioylethanamine

N-methyl-2-methylsulfinothioylethanamine (PubChem CID 122502750) has the molecular formula C4H11NS2 and a molecular weight of 137.27 g/mol. Its IUPAC name is N-methyl-2-methylsulfinothioylethanamine.

Molecular Properties

Compound NameN-methyl-2-methylsulfinothioylethanamine
PubChem CID122502750
Molecular FormulaC4H11NS2
Molecular Weight137.27 g/mol
Exact Mass137.03
IUPAC NameN-methyl-2-methylsulfinothioylethanamine
SMILESCNCCS(C)=S
InChIInChI=1S/C4H11NS2/c1-5-3-4-7(2)6/h5H,3-4H2,1-2H3
InChIKeyWYLNFJKNZLTJOU-UHFFFAOYSA-N
XLogP-0.08
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.27
LogP ≤ 5-0.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-methylsulfinothioylethanamine?
The IUPAC name of N-methyl-2-methylsulfinothioylethanamine (CID 122502750) is N-methyl-2-methylsulfinothioylethanamine.
What is the SMILES notation for N-methyl-2-methylsulfinothioylethanamine?
The canonical SMILES for N-methyl-2-methylsulfinothioylethanamine is CNCCS(C)=S.
What is the InChIKey of N-methyl-2-methylsulfinothioylethanamine?
The InChIKey is WYLNFJKNZLTJOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11NS2/c1-5-3-4-7(2)6/h5H,3-4H2,1-2H3.
What are the key properties of N-methyl-2-methylsulfinothioylethanamine?
N-methyl-2-methylsulfinothioylethanamine has a molecular weight of 137.27 g/mol, XLogP of -0.08, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-methylsulfinothioylethanamine is sourced from PubChem (CID 122502750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).