2-[2-[1-(3-fluorophenyl)-2-methylpropan-2-yl]-1,3-thiazol-4-yl]ethanamine

C15H19FN2S — CID 82155466

IUPAC2-[2-[1-(3-fluorophenyl)-2-methylpropan-2-yl]-1,3-thiazol-4-yl]ethanamine
SMILESCC(C)(Cc1cccc(F)c1)c1nc(CCN)cs1
InChIInChI=1S/C15H19FN2S/c1-15(2,9-11-4-3-5-12(16)8-11)14-18-13(6-7-17)10-19-14/h3-5,8,10H,6-7,9,17H2,1-2H3
InChIKeySHTSIJVGIUKWPS-UHFFFAOYSA-N
MW278.40 g/mol
LogP3.30
Rot. Bonds5

About 2-[2-[1-(3-fluorophenyl)-2-methylpropan-2-yl]-1,3-thiazol-4-yl]ethanamine

2-[2-[1-(3-fluorophenyl)-2-methylpropan-2-yl]-1,3-thiazol-4-yl]ethanamine (PubChem CID 82155466) has the molecular formula C15H19FN2S and a molecular weight of 278.40 g/mol. Its IUPAC name is 2-[2-[1-(3-fluorophenyl)-2-methylpropan-2-yl]-1,3-thiazol-4-yl]ethanamine.

Molecular Properties

Compound Name2-[2-[1-(3-fluorophenyl)-2-methylpropan-2-yl]-1,3-thiazol-4-yl]ethanamine
PubChem CID82155466
Molecular FormulaC15H19FN2S
Molecular Weight278.40 g/mol
Exact Mass278.13
IUPAC Name2-[2-[1-(3-fluorophenyl)-2-methylpropan-2-yl]-1,3-thiazol-4-yl]ethanamine
SMILESCC(C)(Cc1cccc(F)c1)c1nc(CCN)cs1
InChIInChI=1S/C15H19FN2S/c1-15(2,9-11-4-3-5-12(16)8-11)14-18-13(6-7-17)10-19-14/h3-5,8,10H,6-7,9,17H2,1-2H3
InChIKeySHTSIJVGIUKWPS-UHFFFAOYSA-N
XLogP3.30
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[2-[1-(3-fluorophenyl)-2-methylpropan-2-yl]-1,3-thiazol-4-yl]ethanamine 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

2-[1-(3-fluorophenyl)-2-methylpropan-2-yl]-1,3-thiazole-4-carboxylic acid
CID 82155385
2-[2-[2-methyl-1-(4-propan-2-ylphenyl)propan-2-yl]-1,3-thiazol-4-yl]ethanamine
CID 82155456
2-[2-[1-(3-ethyl-4-methoxyphenyl)-2-methylpropan-2-yl]-1,3-thiazol-4-yl]ethanamine
CID 94760893
3-[2-[4-(carboxymethyl)-1,3-thiazol-2-yl]-2-methylpropyl]benzoic acid
CID 94761334
2-(4-tert-butyl-1,3-thiazol-2-yl)-1-(3-fluorophenyl)-N-methylpropan-2-amine
CID 114832560
1-(3-fluorophenyl)-2-methyl-3-phenylpropan-2-amine
CID 115608470
1-(3-fluorophenyl)-2-methyl-3-(1-methylpyrazol-3-yl)propan-2-amine
CID 114834047
2-[2-(2-ethoxybutan-2-yl)-1,3-thiazol-4-yl]ethanamine
CID 116779537
1,2-bis(3-fluorophenyl)propan-2-amine
CID 60799225
azane;1-(2,2-dimethylpropyl)-3-fluorobenzene
CID 174720332
N-[[2-(2-aminoethyl)-1,3-thiazol-4-yl]methyl]-N-ethyl-3-fluoroaniline
CID 66390575
1-(3-chlorophenyl)-3-(3-fluorophenyl)-2-methylpropan-2-amine
CID 114834017

Frequently Asked Questions

What is the IUPAC name of 2-[2-[1-(3-fluorophenyl)-2-methylpropan-2-yl]-1,3-thiazol-4-yl]ethanamine?
The IUPAC name of 2-[2-[1-(3-fluorophenyl)-2-methylpropan-2-yl]-1,3-thiazol-4-yl]ethanamine (CID 82155466) is 2-[2-[1-(3-fluorophenyl)-2-methylpropan-2-yl]-1,3-thiazol-4-yl]ethanamine.
What is the SMILES notation for 2-[2-[1-(3-fluorophenyl)-2-methylpropan-2-yl]-1,3-thiazol-4-yl]ethanamine?
The canonical SMILES for 2-[2-[1-(3-fluorophenyl)-2-methylpropan-2-yl]-1,3-thiazol-4-yl]ethanamine is CC(C)(Cc1cccc(F)c1)c1nc(CCN)cs1.
What is the InChIKey of 2-[2-[1-(3-fluorophenyl)-2-methylpropan-2-yl]-1,3-thiazol-4-yl]ethanamine?
The InChIKey is SHTSIJVGIUKWPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FN2S/c1-15(2,9-11-4-3-5-12(16)8-11)14-18-13(6-7-17)10-19-14/h3-5,8,10H,6-7,9,17H2,1-2H3.
What are the key properties of 2-[2-[1-(3-fluorophenyl)-2-methylpropan-2-yl]-1,3-thiazol-4-yl]ethanamine?
2-[2-[1-(3-fluorophenyl)-2-methylpropan-2-yl]-1,3-thiazol-4-yl]ethanamine has a molecular weight of 278.40 g/mol, XLogP of 3.30, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[1-(3-fluorophenyl)-2-methylpropan-2-yl]-1,3-thiazol-4-yl]ethanamine is sourced from PubChem (CID 82155466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).