1-(2-fluorophenyl)sulfanyl-N-methyl-3-pyridin-2-ylpropan-2-amine

C15H17FN2S — CID 66053856

IUPAC1-(2-fluorophenyl)sulfanyl-N-methyl-3-pyridin-2-ylpropan-2-amine
SMILESCNC(CSc1ccccc1F)Cc1ccccn1
InChIInChI=1S/C15H17FN2S/c1-17-13(10-12-6-4-5-9-18-12)11-19-15-8-3-2-7-14(15)16/h2-9,13,17H,10-11H2,1H3
InChIKeyZFILOROUBJMYOU-UHFFFAOYSA-N
MW276.38 g/mol
LogP3.14
Rot. Bonds6

About 1-(2-fluorophenyl)sulfanyl-N-methyl-3-pyridin-2-ylpropan-2-amine

1-(2-fluorophenyl)sulfanyl-N-methyl-3-pyridin-2-ylpropan-2-amine (PubChem CID 66053856) has the molecular formula C15H17FN2S and a molecular weight of 276.38 g/mol. Its IUPAC name is 1-(2-fluorophenyl)sulfanyl-N-methyl-3-pyridin-2-ylpropan-2-amine.

Molecular Properties

Compound Name1-(2-fluorophenyl)sulfanyl-N-methyl-3-pyridin-2-ylpropan-2-amine
PubChem CID66053856
Molecular FormulaC15H17FN2S
Molecular Weight276.38 g/mol
Exact Mass276.11
IUPAC Name1-(2-fluorophenyl)sulfanyl-N-methyl-3-pyridin-2-ylpropan-2-amine
SMILESCNC(CSc1ccccc1F)Cc1ccccn1
InChIInChI=1S/C15H17FN2S/c1-17-13(10-12-6-4-5-9-18-12)11-19-15-8-3-2-7-14(15)16/h2-9,13,17H,10-11H2,1H3
InChIKeyZFILOROUBJMYOU-UHFFFAOYSA-N
XLogP3.14
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(2-fluorophenyl)sulfanyl-N-methyl-3-pyridin-2-ylpropan-2-amine with MolForge

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

Launch Full Analysis

Related Compounds

1-(2-fluorophenyl)sulfanyl-3-pyridin-2-ylpropan-2-amine
CID 66051531
4-[3-(2-fluorophenyl)sulfanyl-2-(methylamino)propyl]pyridin-2-amine
CID 66051154
1-(2-fluorophenyl)sulfanyl-N-methyl-3-(2-methyl-1,3-thiazol-4-yl)propan-2-amine
CID 66053665
1-(4-fluorophenyl)-3-(2-fluorophenyl)sulfanyl-N-methylpropan-2-amine
CID 66051929
1-(2-fluorophenyl)sulfanyl-N-methyl-3-(2-methylphenyl)propan-2-amine
CID 66051734
1-(2,4-difluorophenyl)-3-(2-fluorophenyl)sulfanyl-N-methylpropan-2-amine
CID 66054054
1-(2,6-difluorophenyl)-N-methyl-4-pyridin-2-ylbutan-2-amine
CID 105190641
1-(5-bromothiophen-2-yl)-3-(2-fluorophenyl)sulfanyl-N-methylpropan-2-amine
CID 66053278
1-(2-bromo-5-fluorophenyl)-3-(2-fluorophenyl)sulfanyl-N-methylpropan-2-amine
CID 66053668
N-ethyl-1-(3-fluorophenyl)sulfanyl-3-pyridin-2-ylpropan-2-amine
CID 66070640
2-(2-fluorophenyl)sulfanyl-N-(pyridin-2-ylmethyl)acetamide
CID 47005105
1-(2-fluorophenyl)sulfanyl-N-methylhept-6-en-2-amine
CID 66054051

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)sulfanyl-N-methyl-3-pyridin-2-ylpropan-2-amine?
The IUPAC name of 1-(2-fluorophenyl)sulfanyl-N-methyl-3-pyridin-2-ylpropan-2-amine (CID 66053856) is 1-(2-fluorophenyl)sulfanyl-N-methyl-3-pyridin-2-ylpropan-2-amine.
What is the SMILES notation for 1-(2-fluorophenyl)sulfanyl-N-methyl-3-pyridin-2-ylpropan-2-amine?
The canonical SMILES for 1-(2-fluorophenyl)sulfanyl-N-methyl-3-pyridin-2-ylpropan-2-amine is CNC(CSc1ccccc1F)Cc1ccccn1.
What is the InChIKey of 1-(2-fluorophenyl)sulfanyl-N-methyl-3-pyridin-2-ylpropan-2-amine?
The InChIKey is ZFILOROUBJMYOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN2S/c1-17-13(10-12-6-4-5-9-18-12)11-19-15-8-3-2-7-14(15)16/h2-9,13,17H,10-11H2,1H3.
What are the key properties of 1-(2-fluorophenyl)sulfanyl-N-methyl-3-pyridin-2-ylpropan-2-amine?
1-(2-fluorophenyl)sulfanyl-N-methyl-3-pyridin-2-ylpropan-2-amine has a molecular weight of 276.38 g/mol, XLogP of 3.14, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)sulfanyl-N-methyl-3-pyridin-2-ylpropan-2-amine is sourced from PubChem (CID 66053856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).