6-(2-chloro-6-fluorophenyl)-N-(2-ethenyl-6-methylphenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-amine

C21H17ClFN3S — CID 143803819

IUPAC6-(2-chloro-6-fluorophenyl)-N-(2-ethenyl-6-methylphenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-amine
SMILESC=Cc1cccc(C)c1Nc1c(-c2c(F)cccc2Cl)nc2scc(C)n12
InChIInChI=1S/C21H17ClFN3S/c1-4-14-8-5-7-12(2)18(14)24-20-19(17-15(22)9-6-10-16(17)23)25-21-26(20)13(3)11-27-21/h4-11,24H,1H2,2-3H3
InChIKeySEEYAGYYLYDBIZ-UHFFFAOYSA-N
MW397.91 g/mol
LogP6.86
Rot. Bonds4

About 6-(2-chloro-6-fluorophenyl)-N-(2-ethenyl-6-methylphenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-amine

6-(2-chloro-6-fluorophenyl)-N-(2-ethenyl-6-methylphenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-amine (PubChem CID 143803819) has the molecular formula C21H17ClFN3S and a molecular weight of 397.91 g/mol. Its IUPAC name is 6-(2-chloro-6-fluorophenyl)-N-(2-ethenyl-6-methylphenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-amine.

Molecular Properties

Compound Name6-(2-chloro-6-fluorophenyl)-N-(2-ethenyl-6-methylphenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-amine
PubChem CID143803819
Molecular FormulaC21H17ClFN3S
Molecular Weight397.91 g/mol
Exact Mass397.08
IUPAC Name6-(2-chloro-6-fluorophenyl)-N-(2-ethenyl-6-methylphenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-amine
SMILESC=Cc1cccc(C)c1Nc1c(-c2c(F)cccc2Cl)nc2scc(C)n12
InChIInChI=1S/C21H17ClFN3S/c1-4-14-8-5-7-12(2)18(14)24-20-19(17-15(22)9-6-10-16(17)23)25-21-26(20)13(3)11-27-21/h4-11,24H,1H2,2-3H3
InChIKeySEEYAGYYLYDBIZ-UHFFFAOYSA-N
XLogP6.86
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500397.91
LogP ≤ 56.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-(2-chloro-6-fluorophenyl)-N-(2-ethenyl-6-methylphenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-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-(2-chloro-6-methylphenyl)-6-(2,6-difluorophenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-amine
CID 59579091
6-(2,6-difluorophenyl)-N-(2,6-dimethylphenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-amine
CID 59579087
N-(2-chloro-6-methylphenyl)-6-(2,6-difluorophenyl)-2,3-dimethylimidazo[2,1-b][1,3]thiazol-5-amine
CID 59579210
6-(2-fluoro-6-iodophenyl)-N-(4-fluorophenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-amine
CID 70832089
N-(2,6-dimethylphenyl)-6-(2-fluoro-6-iodophenyl)-3-phenylimidazo[2,1-b][1,3]thiazol-5-amine
CID 70832151
N-(2-chloro-6-methylphenyl)-6-(2,6-difluorophenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-amine;N-(2-chloro-6-methylphenyl)-2-(2,6-difluorophenyl)-5-(trifluoromethyl)imidazo[1,2-a]pyridin-3-amine;N-cyclohexyl-6-(2,6-difluorophenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-amine;N-cyclohexyl-2-(2,6-difluorophenyl)-5-(trifluoromethyl)imidazo[1,2-a]pyridin-3-amine;N-cyclopentyl-6-(2,6-difluorophenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-amine;N-cyclopentyl-2-(2,6-difluorophenyl)-5-(trifluoromethyl)imidazo[1,2-a]pyridin-3-amine;6-(2,6-difluorophenyl)-N-(2,6-dimethylphenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-amine;2-(2,6-difluorophenyl)-N-(2,6-dimethylphenyl)-5-(trifluoromethyl)imidazo[1,2-a]pyridin-3-amine;6-(2,6-difluorophenyl)-N-(4-fluorophenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-amine;2-(2,6-difluorophenyl)-N-(4-fluorophenyl)-5-(trifluoromethyl)imidazo[1,2-a]pyridin-3-amine
CID 158447438
N-(2-chloro-6-methylphenyl)-2-(2-fluorophenyl)-5-methylimidazo[1,2-a]pyridin-3-amine
CID 59579102
6-(2-chloro-4-fluorophenyl)-N-(2-chloro-6-methylphenyl)-3-phenylimidazo[2,1-b][1,3]thiazol-5-amine
CID 59579069
N-(2,6-dimethylphenyl)-6-(2-fluoro-6-methylphenyl)-2,3-dimethylimidazo[2,1-b][1,3]thiazol-5-amine
CID 71016402
6-(2-chloro-4-fluorophenyl)-N-(2,6-dimethylphenyl)-3-ethylimidazo[2,1-b][1,3]thiazol-5-amine
CID 70832437
6-(2-chloro-6-fluorophenyl)-N-(4-fluorophenyl)-2,3-dimethylimidazo[2,1-b][1,3]thiazol-5-amine
CID 59578837
2-[5-(2-chloro-6-methylanilino)-6-(2-iodophenyl)imidazo[2,1-b][1,3]thiazol-3-yl]acetaldehyde
CID 89011527

Frequently Asked Questions

What is the IUPAC name of 6-(2-chloro-6-fluorophenyl)-N-(2-ethenyl-6-methylphenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-amine?
The IUPAC name of 6-(2-chloro-6-fluorophenyl)-N-(2-ethenyl-6-methylphenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-amine (CID 143803819) is 6-(2-chloro-6-fluorophenyl)-N-(2-ethenyl-6-methylphenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-amine.
What is the SMILES notation for 6-(2-chloro-6-fluorophenyl)-N-(2-ethenyl-6-methylphenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-amine?
The canonical SMILES for 6-(2-chloro-6-fluorophenyl)-N-(2-ethenyl-6-methylphenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-amine is C=Cc1cccc(C)c1Nc1c(-c2c(F)cccc2Cl)nc2scc(C)n12.
What is the InChIKey of 6-(2-chloro-6-fluorophenyl)-N-(2-ethenyl-6-methylphenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-amine?
The InChIKey is SEEYAGYYLYDBIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17ClFN3S/c1-4-14-8-5-7-12(2)18(14)24-20-19(17-15(22)9-6-10-16(17)23)25-21-26(20)13(3)11-27-21/h4-11,24H,1H2,2-3H3.
What are the key properties of 6-(2-chloro-6-fluorophenyl)-N-(2-ethenyl-6-methylphenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-amine?
6-(2-chloro-6-fluorophenyl)-N-(2-ethenyl-6-methylphenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-amine has a molecular weight of 397.91 g/mol, XLogP of 6.86, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-chloro-6-fluorophenyl)-N-(2-ethenyl-6-methylphenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-amine is sourced from PubChem (CID 143803819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).