N-(2-fluorophenyl)-4-thiophen-2-yl-1,3-thiazol-2-amine

C13H9FN2S2 — CID 686059

IUPACN-(2-fluorophenyl)-4-thiophen-2-yl-1,3-thiazol-2-amine
SMILESFc1ccccc1Nc1nc(-c2cccs2)cs1
InChIInChI=1S/C13H9FN2S2/c14-9-4-1-2-5-10(9)15-13-16-11(8-18-13)12-6-3-7-17-12/h1-8H,(H,15,16)
InChIKeyKWUDFBOZCCCWTK-UHFFFAOYSA-N
MW276.36 g/mol
LogP4.75
Rot. Bonds3

About N-(2-fluorophenyl)-4-thiophen-2-yl-1,3-thiazol-2-amine

N-(2-fluorophenyl)-4-thiophen-2-yl-1,3-thiazol-2-amine (PubChem CID 686059) has the molecular formula C13H9FN2S2 and a molecular weight of 276.36 g/mol. Its IUPAC name is N-(2-fluorophenyl)-4-thiophen-2-yl-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(2-fluorophenyl)-4-thiophen-2-yl-1,3-thiazol-2-amine
PubChem CID686059
Molecular FormulaC13H9FN2S2
Molecular Weight276.36 g/mol
Exact Mass276.02
IUPAC NameN-(2-fluorophenyl)-4-thiophen-2-yl-1,3-thiazol-2-amine
SMILESFc1ccccc1Nc1nc(-c2cccs2)cs1
InChIInChI=1S/C13H9FN2S2/c14-9-4-1-2-5-10(9)15-13-16-11(8-18-13)12-6-3-7-17-12/h1-8H,(H,15,16)
InChIKeyKWUDFBOZCCCWTK-UHFFFAOYSA-N
XLogP4.75
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.36
LogP ≤ 54.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(2-fluorophenyl)-4-thiophen-2-yl-1,3-thiazol-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

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-4-thiophen-2-yl-1,3-thiazol-2-amine?
The IUPAC name of N-(2-fluorophenyl)-4-thiophen-2-yl-1,3-thiazol-2-amine (CID 686059) is N-(2-fluorophenyl)-4-thiophen-2-yl-1,3-thiazol-2-amine.
What is the SMILES notation for N-(2-fluorophenyl)-4-thiophen-2-yl-1,3-thiazol-2-amine?
The canonical SMILES for N-(2-fluorophenyl)-4-thiophen-2-yl-1,3-thiazol-2-amine is Fc1ccccc1Nc1nc(-c2cccs2)cs1.
What is the InChIKey of N-(2-fluorophenyl)-4-thiophen-2-yl-1,3-thiazol-2-amine?
The InChIKey is KWUDFBOZCCCWTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9FN2S2/c14-9-4-1-2-5-10(9)15-13-16-11(8-18-13)12-6-3-7-17-12/h1-8H,(H,15,16).
What are the key properties of N-(2-fluorophenyl)-4-thiophen-2-yl-1,3-thiazol-2-amine?
N-(2-fluorophenyl)-4-thiophen-2-yl-1,3-thiazol-2-amine has a molecular weight of 276.36 g/mol, XLogP of 4.75, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-4-thiophen-2-yl-1,3-thiazol-2-amine is sourced from PubChem (CID 686059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).