2-[fluoro(dimethyl)-λ4-sulfanyl]-N-methylethanamine

C5H14FNS — CID 142057524

IUPAC2-[fluoro(dimethyl)-λ4-sulfanyl]-N-methylethanamine
SMILESCNCCS(C)(C)F
InChIInChI=1S/C5H14FNS/c1-7-4-5-8(2,3)6/h7H,4-5H2,1-3H3
InChIKeyGOWWIEGVRYVTOE-UHFFFAOYSA-N
MW139.24 g/mol
LogP1.15
Rot. Bonds3

About 2-[fluoro(dimethyl)-λ4-sulfanyl]-N-methylethanamine

2-[fluoro(dimethyl)-λ4-sulfanyl]-N-methylethanamine (PubChem CID 142057524) has the molecular formula C5H14FNS and a molecular weight of 139.24 g/mol. Its IUPAC name is 2-[fluoro(dimethyl)-λ4-sulfanyl]-N-methylethanamine.

Molecular Properties

Compound Name2-[fluoro(dimethyl)-λ4-sulfanyl]-N-methylethanamine
PubChem CID142057524
Molecular FormulaC5H14FNS
Molecular Weight139.24 g/mol
Exact Mass139.08
IUPAC Name2-[fluoro(dimethyl)-λ4-sulfanyl]-N-methylethanamine
SMILESCNCCS(C)(C)F
InChIInChI=1S/C5H14FNS/c1-7-4-5-8(2,3)6/h7H,4-5H2,1-3H3
InChIKeyGOWWIEGVRYVTOE-UHFFFAOYSA-N
XLogP1.15
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.24
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-[fluoro(dimethyl)-λ4-sulfanyl]-N-methylethanamine 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 2-[fluoro(dimethyl)-λ4-sulfanyl]-N-methylethanamine?
The IUPAC name of 2-[fluoro(dimethyl)-λ4-sulfanyl]-N-methylethanamine (CID 142057524) is 2-[fluoro(dimethyl)-λ4-sulfanyl]-N-methylethanamine.
What is the SMILES notation for 2-[fluoro(dimethyl)-λ4-sulfanyl]-N-methylethanamine?
The canonical SMILES for 2-[fluoro(dimethyl)-λ4-sulfanyl]-N-methylethanamine is CNCCS(C)(C)F.
What is the InChIKey of 2-[fluoro(dimethyl)-λ4-sulfanyl]-N-methylethanamine?
The InChIKey is GOWWIEGVRYVTOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H14FNS/c1-7-4-5-8(2,3)6/h7H,4-5H2,1-3H3.
What are the key properties of 2-[fluoro(dimethyl)-λ4-sulfanyl]-N-methylethanamine?
2-[fluoro(dimethyl)-λ4-sulfanyl]-N-methylethanamine has a molecular weight of 139.24 g/mol, XLogP of 1.15, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[fluoro(dimethyl)-λ4-sulfanyl]-N-methylethanamine is sourced from PubChem (CID 142057524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).