N-(3-fluoro-4-methylphenyl)-1,3-thiazol-2-amine

C10H9FN2S — CID 87538093

IUPACN-(3-fluoro-4-methylphenyl)-1,3-thiazol-2-amine
SMILESCc1ccc(Nc2nccs2)cc1F
InChIInChI=1S/C10H9FN2S/c1-7-2-3-8(6-9(7)11)13-10-12-4-5-14-10/h2-6H,1H3,(H,12,13)
InChIKeyUTRWQZKYYJOKTB-UHFFFAOYSA-N
MW208.26 g/mol
LogP3.33
Rot. Bonds2

About N-(3-fluoro-4-methylphenyl)-1,3-thiazol-2-amine

N-(3-fluoro-4-methylphenyl)-1,3-thiazol-2-amine (PubChem CID 87538093) has the molecular formula C10H9FN2S and a molecular weight of 208.26 g/mol. Its IUPAC name is N-(3-fluoro-4-methylphenyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(3-fluoro-4-methylphenyl)-1,3-thiazol-2-amine
PubChem CID87538093
Molecular FormulaC10H9FN2S
Molecular Weight208.26 g/mol
Exact Mass208.05
IUPAC NameN-(3-fluoro-4-methylphenyl)-1,3-thiazol-2-amine
SMILESCc1ccc(Nc2nccs2)cc1F
InChIInChI=1S/C10H9FN2S/c1-7-2-3-8(6-9(7)11)13-10-12-4-5-14-10/h2-6H,1H3,(H,12,13)
InChIKeyUTRWQZKYYJOKTB-UHFFFAOYSA-N
XLogP3.33
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(3-fluoro-4-methylphenyl)-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-(3-fluoro-4-methylphenyl)-1,3-thiazol-2-amine?
The IUPAC name of N-(3-fluoro-4-methylphenyl)-1,3-thiazol-2-amine (CID 87538093) is N-(3-fluoro-4-methylphenyl)-1,3-thiazol-2-amine.
What is the SMILES notation for N-(3-fluoro-4-methylphenyl)-1,3-thiazol-2-amine?
The canonical SMILES for N-(3-fluoro-4-methylphenyl)-1,3-thiazol-2-amine is Cc1ccc(Nc2nccs2)cc1F.
What is the InChIKey of N-(3-fluoro-4-methylphenyl)-1,3-thiazol-2-amine?
The InChIKey is UTRWQZKYYJOKTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9FN2S/c1-7-2-3-8(6-9(7)11)13-10-12-4-5-14-10/h2-6H,1H3,(H,12,13).
What are the key properties of N-(3-fluoro-4-methylphenyl)-1,3-thiazol-2-amine?
N-(3-fluoro-4-methylphenyl)-1,3-thiazol-2-amine has a molecular weight of 208.26 g/mol, XLogP of 3.33, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluoro-4-methylphenyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 87538093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).