N-(4-fluoro-3-methylphenyl)-4-phenyl-4,5-dihydro-1,3-thiazol-2-amine

C16H15FN2S — CID 63184109

IUPACN-(4-fluoro-3-methylphenyl)-4-phenyl-4,5-dihydro-1,3-thiazol-2-amine
SMILESCc1cc(NC2=NC(c3ccccc3)CS2)ccc1F
InChIInChI=1S/C16H15FN2S/c1-11-9-13(7-8-14(11)17)18-16-19-15(10-20-16)12-5-3-2-4-6-12/h2-9,15H,10H2,1H3,(H,18,19)
InChIKeyZFCAOITZTGAWRF-UHFFFAOYSA-N
MW286.38 g/mol
LogP4.39
Rot. Bonds2

About N-(4-fluoro-3-methylphenyl)-4-phenyl-4,5-dihydro-1,3-thiazol-2-amine

N-(4-fluoro-3-methylphenyl)-4-phenyl-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 63184109) has the molecular formula C16H15FN2S and a molecular weight of 286.38 g/mol. Its IUPAC name is N-(4-fluoro-3-methylphenyl)-4-phenyl-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(4-fluoro-3-methylphenyl)-4-phenyl-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID63184109
Molecular FormulaC16H15FN2S
Molecular Weight286.38 g/mol
Exact Mass286.09
IUPAC NameN-(4-fluoro-3-methylphenyl)-4-phenyl-4,5-dihydro-1,3-thiazol-2-amine
SMILESCc1cc(NC2=NC(c3ccccc3)CS2)ccc1F
InChIInChI=1S/C16H15FN2S/c1-11-9-13(7-8-14(11)17)18-16-19-15(10-20-16)12-5-3-2-4-6-12/h2-9,15H,10H2,1H3,(H,18,19)
InChIKeyZFCAOITZTGAWRF-UHFFFAOYSA-N
XLogP4.39
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(4-fluoro-3-methylphenyl)-4-phenyl-4,5-dihydro-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

Related Compounds

N-(3-chloro-4-methylphenyl)-4-phenyl-4,5-dihydro-1,3-thiazol-2-amine
CID 63183024
N-(2,5-difluoro-4-methylphenyl)-4-phenyl-4,5-dihydro-1,3-thiazol-2-amine
CID 103586627
N-(4-chloro-3-fluorophenyl)-4-phenyl-4,5-dihydro-1,3-thiazol-2-amine
CID 63182970
N-(3-fluoro-5-methylphenyl)-4-phenyl-4,5-dihydro-1,3-thiazol-2-amine
CID 79049823
N-(3-methylphenyl)-4-phenyl-4,5-dihydro-1,3-thiazol-2-amine
CID 63183120
N-(3,5-difluorophenyl)-4-phenyl-4,5-dihydro-1,3-thiazol-2-amine
CID 63182910
N-(2,6-dimethylphenyl)-4-phenyl-4,5-dihydro-1,3-thiazol-2-amine
CID 63182912
N-(4-fluoro-3-methylphenyl)-4-(2-methoxyethyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 114211017
N-(5-bromo-2,4-difluorophenyl)-4-phenyl-4,5-dihydro-1,3-thiazol-2-amine
CID 102854291
4-phenyl-N-thiophen-3-yl-4,5-dihydro-1,3-thiazol-2-amine
CID 66349772
4-benzyl-N-(3-fluoro-4-methylphenyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 63261697
4-[(4-phenyl-4,5-dihydro-1,3-thiazol-2-yl)amino]benzamide
CID 63183072

Frequently Asked Questions

What is the IUPAC name of N-(4-fluoro-3-methylphenyl)-4-phenyl-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of N-(4-fluoro-3-methylphenyl)-4-phenyl-4,5-dihydro-1,3-thiazol-2-amine (CID 63184109) is N-(4-fluoro-3-methylphenyl)-4-phenyl-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for N-(4-fluoro-3-methylphenyl)-4-phenyl-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for N-(4-fluoro-3-methylphenyl)-4-phenyl-4,5-dihydro-1,3-thiazol-2-amine is Cc1cc(NC2=NC(c3ccccc3)CS2)ccc1F.
What is the InChIKey of N-(4-fluoro-3-methylphenyl)-4-phenyl-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is ZFCAOITZTGAWRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15FN2S/c1-11-9-13(7-8-14(11)17)18-16-19-15(10-20-16)12-5-3-2-4-6-12/h2-9,15H,10H2,1H3,(H,18,19).
What are the key properties of N-(4-fluoro-3-methylphenyl)-4-phenyl-4,5-dihydro-1,3-thiazol-2-amine?
N-(4-fluoro-3-methylphenyl)-4-phenyl-4,5-dihydro-1,3-thiazol-2-amine has a molecular weight of 286.38 g/mol, XLogP of 4.39, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluoro-3-methylphenyl)-4-phenyl-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 63184109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).