N-(N,S-dimethylsulfonimidoyl)-N-ethylethanamine

C6H16N2OS — CID 170187971

IUPACN-(N,S-dimethylsulfonimidoyl)-N-ethylethanamine
SMILESCCN(CC)S(C)(=O)=NC
InChIInChI=1S/C6H16N2OS/c1-5-8(6-2)10(4,9)7-3/h5-6H2,1-4H3
InChIKeyJEFCKBHODGPWQQ-UHFFFAOYSA-N
MW164.27 g/mol
LogP0.97
Rot. Bonds3

About N-(N,S-dimethylsulfonimidoyl)-N-ethylethanamine

N-(N,S-dimethylsulfonimidoyl)-N-ethylethanamine (PubChem CID 170187971) has the molecular formula C6H16N2OS and a molecular weight of 164.27 g/mol. Its IUPAC name is N-(N,S-dimethylsulfonimidoyl)-N-ethylethanamine.

Molecular Properties

Compound NameN-(N,S-dimethylsulfonimidoyl)-N-ethylethanamine
PubChem CID170187971
Molecular FormulaC6H16N2OS
Molecular Weight164.27 g/mol
Exact Mass164.10
IUPAC NameN-(N,S-dimethylsulfonimidoyl)-N-ethylethanamine
SMILESCCN(CC)S(C)(=O)=NC
InChIInChI=1S/C6H16N2OS/c1-5-8(6-2)10(4,9)7-3/h5-6H2,1-4H3
InChIKeyJEFCKBHODGPWQQ-UHFFFAOYSA-N
XLogP0.97
TPSA32.67 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.27
LogP ≤ 50.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(N,S-dimethylsulfonimidoyl)-N-ethylethanamine?
The IUPAC name of N-(N,S-dimethylsulfonimidoyl)-N-ethylethanamine (CID 170187971) is N-(N,S-dimethylsulfonimidoyl)-N-ethylethanamine.
What is the SMILES notation for N-(N,S-dimethylsulfonimidoyl)-N-ethylethanamine?
The canonical SMILES for N-(N,S-dimethylsulfonimidoyl)-N-ethylethanamine is CCN(CC)S(C)(=O)=NC.
What is the InChIKey of N-(N,S-dimethylsulfonimidoyl)-N-ethylethanamine?
The InChIKey is JEFCKBHODGPWQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H16N2OS/c1-5-8(6-2)10(4,9)7-3/h5-6H2,1-4H3.
What are the key properties of N-(N,S-dimethylsulfonimidoyl)-N-ethylethanamine?
N-(N,S-dimethylsulfonimidoyl)-N-ethylethanamine has a molecular weight of 164.27 g/mol, XLogP of 0.97, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(N,S-dimethylsulfonimidoyl)-N-ethylethanamine is sourced from PubChem (CID 170187971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).