N-methyl-N-(methylsulfonimidoyl)ethanamine

C4H12N2OS — CID 167507652

IUPACN-methyl-N-(methylsulfonimidoyl)ethanamine
SMILES[H]N=S(C)(=O)N(C)CC
InChIInChI=1S/C4H12N2OS/c1-4-6(2)8(3,5)7/h5H,4H2,1-3H3
InChIKeySWBGZACKLNMSSF-UHFFFAOYSA-N
MW136.22 g/mol
LogP0.53
Rot. Bonds2

About N-methyl-N-(methylsulfonimidoyl)ethanamine

N-methyl-N-(methylsulfonimidoyl)ethanamine (PubChem CID 167507652) has the molecular formula C4H12N2OS and a molecular weight of 136.22 g/mol. Its IUPAC name is N-methyl-N-(methylsulfonimidoyl)ethanamine.

Molecular Properties

Compound NameN-methyl-N-(methylsulfonimidoyl)ethanamine
PubChem CID167507652
Molecular FormulaC4H12N2OS
Molecular Weight136.22 g/mol
Exact Mass136.07
IUPAC NameN-methyl-N-(methylsulfonimidoyl)ethanamine
SMILES[H]N=S(C)(=O)N(C)CC
InChIInChI=1S/C4H12N2OS/c1-4-6(2)8(3,5)7/h5H,4H2,1-3H3
InChIKeySWBGZACKLNMSSF-UHFFFAOYSA-N
XLogP0.53
TPSA44.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.22
LogP ≤ 50.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(methylsulfonimidoyl)ethanamine?
The IUPAC name of N-methyl-N-(methylsulfonimidoyl)ethanamine (CID 167507652) is N-methyl-N-(methylsulfonimidoyl)ethanamine.
What is the SMILES notation for N-methyl-N-(methylsulfonimidoyl)ethanamine?
The canonical SMILES for N-methyl-N-(methylsulfonimidoyl)ethanamine is [H]N=S(C)(=O)N(C)CC.
What is the InChIKey of N-methyl-N-(methylsulfonimidoyl)ethanamine?
The InChIKey is SWBGZACKLNMSSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H12N2OS/c1-4-6(2)8(3,5)7/h5H,4H2,1-3H3.
What are the key properties of N-methyl-N-(methylsulfonimidoyl)ethanamine?
N-methyl-N-(methylsulfonimidoyl)ethanamine has a molecular weight of 136.22 g/mol, XLogP of 0.53, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(methylsulfonimidoyl)ethanamine is sourced from PubChem (CID 167507652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).