N-ethyl-N-methyl-2-methylsulfanylethanamine

C6H15NS — CID 59155211

IUPACN-ethyl-N-methyl-2-methylsulfanylethanamine
SMILESCCN(C)CCSC
InChIInChI=1S/C6H15NS/c1-4-7(2)5-6-8-3/h4-6H2,1-3H3
InChIKeySTGBVIOVUSUXCZ-UHFFFAOYSA-N
MW133.26 g/mol
LogP1.30
Rot. Bonds4

About N-ethyl-N-methyl-2-methylsulfanylethanamine

N-ethyl-N-methyl-2-methylsulfanylethanamine (PubChem CID 59155211) has the molecular formula C6H15NS and a molecular weight of 133.26 g/mol. Its IUPAC name is N-ethyl-N-methyl-2-methylsulfanylethanamine.

Molecular Properties

Compound NameN-ethyl-N-methyl-2-methylsulfanylethanamine
PubChem CID59155211
Molecular FormulaC6H15NS
Molecular Weight133.26 g/mol
Exact Mass133.09
IUPAC NameN-ethyl-N-methyl-2-methylsulfanylethanamine
SMILESCCN(C)CCSC
InChIInChI=1S/C6H15NS/c1-4-7(2)5-6-8-3/h4-6H2,1-3H3
InChIKeySTGBVIOVUSUXCZ-UHFFFAOYSA-N
XLogP1.30
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.26
LogP ≤ 51.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-ethyl-N-methyl-2-methylsulfanylethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methyl-2-methylsulfanylethanamine?
The IUPAC name of N-ethyl-N-methyl-2-methylsulfanylethanamine (CID 59155211) is N-ethyl-N-methyl-2-methylsulfanylethanamine.
What is the SMILES notation for N-ethyl-N-methyl-2-methylsulfanylethanamine?
The canonical SMILES for N-ethyl-N-methyl-2-methylsulfanylethanamine is CCN(C)CCSC.
What is the InChIKey of N-ethyl-N-methyl-2-methylsulfanylethanamine?
The InChIKey is STGBVIOVUSUXCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15NS/c1-4-7(2)5-6-8-3/h4-6H2,1-3H3.
What are the key properties of N-ethyl-N-methyl-2-methylsulfanylethanamine?
N-ethyl-N-methyl-2-methylsulfanylethanamine has a molecular weight of 133.26 g/mol, XLogP of 1.30, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methyl-2-methylsulfanylethanamine is sourced from PubChem (CID 59155211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).