2-[6-(4-ethylphenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-yl]ethanamine

C16H19N3S — CID 39194934

IUPAC2-[6-(4-ethylphenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-yl]ethanamine
SMILESCCc1ccc(-c2nc3scc(C)n3c2CCN)cc1
InChIInChI=1S/C16H19N3S/c1-3-12-4-6-13(7-5-12)15-14(8-9-17)19-11(2)10-20-16(19)18-15/h4-7,10H,3,8-9,17H2,1-2H3
InChIKeyFPGVRZCVIISZJW-UHFFFAOYSA-N
MW285.42 g/mol
LogP3.43
Rot. Bonds4

About 2-[6-(4-ethylphenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-yl]ethanamine

2-[6-(4-ethylphenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-yl]ethanamine (PubChem CID 39194934) has the molecular formula C16H19N3S and a molecular weight of 285.42 g/mol. Its IUPAC name is 2-[6-(4-ethylphenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-yl]ethanamine.

Molecular Properties

Compound Name2-[6-(4-ethylphenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-yl]ethanamine
PubChem CID39194934
Molecular FormulaC16H19N3S
Molecular Weight285.42 g/mol
Exact Mass285.13
IUPAC Name2-[6-(4-ethylphenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-yl]ethanamine
SMILESCCc1ccc(-c2nc3scc(C)n3c2CCN)cc1
InChIInChI=1S/C16H19N3S/c1-3-12-4-6-13(7-5-12)15-14(8-9-17)19-11(2)10-20-16(19)18-15/h4-7,10H,3,8-9,17H2,1-2H3
InChIKeyFPGVRZCVIISZJW-UHFFFAOYSA-N
XLogP3.43
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.42
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[6-(4-fluorophenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-yl]ethanamine
CID 39194944
2-[3-methyl-6-(5,6,7,8-tetrahydronaphthalen-2-yl)imidazo[2,1-b][1,3]thiazol-5-yl]ethanamine
CID 39194938
2-(3,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl)ethanamine
CID 39194990
1-[4-(5-ethyl-3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]ethanamine
CID 82025704
2-[6-(3,4-dimethylphenyl)-3-propan-2-ylimidazo[2,1-b][1,3]thiazol-5-yl]ethanamine
CID 93210815
6-(4-fluorophenyl)-3,5-dimethylimidazo[2,1-b][1,3]thiazole
CID 113225126
2-[6-(3,4-dichlorophenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-yl]acetonitrile
CID 93210700
6-(4-methoxyphenyl)-3,5-dimethylimidazo[2,1-b][1,3]thiazole
CID 113225125
6-(4-ethylphenyl)-2,3,5-trimethylimidazo[2,1-b][1,3]thiazole
CID 83086720
2-[3-(4-bromophenyl)-6-methylimidazo[2,1-b][1,3]thiazol-5-yl]ethanamine
CID 39194860
2-[4-(3-ethyl-6-methylimidazo[1,2-a]pyridin-2-yl)phenyl]ethanamine
CID 82025667
2-[3-methyl-6-(5,6,7,8-tetrahydronaphthalen-2-yl)imidazo[2,1-b][1,3]thiazol-5-yl]acetic acid
CID 82062351

Frequently Asked Questions

What is the IUPAC name of 2-[6-(4-ethylphenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-yl]ethanamine?
The IUPAC name of 2-[6-(4-ethylphenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-yl]ethanamine (CID 39194934) is 2-[6-(4-ethylphenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-yl]ethanamine.
What is the SMILES notation for 2-[6-(4-ethylphenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-yl]ethanamine?
The canonical SMILES for 2-[6-(4-ethylphenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-yl]ethanamine is CCc1ccc(-c2nc3scc(C)n3c2CCN)cc1.
What is the InChIKey of 2-[6-(4-ethylphenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-yl]ethanamine?
The InChIKey is FPGVRZCVIISZJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3S/c1-3-12-4-6-13(7-5-12)15-14(8-9-17)19-11(2)10-20-16(19)18-15/h4-7,10H,3,8-9,17H2,1-2H3.
What are the key properties of 2-[6-(4-ethylphenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-yl]ethanamine?
2-[6-(4-ethylphenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-yl]ethanamine has a molecular weight of 285.42 g/mol, XLogP of 3.43, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(4-ethylphenyl)-3-methylimidazo[2,1-b][1,3]thiazol-5-yl]ethanamine is sourced from PubChem (CID 39194934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).