6-ethyl-3-phenylimidazo[2,1-b][1,3]thiazol-5-amine

C13H13N3S — CID 82372908

IUPAC6-ethyl-3-phenylimidazo[2,1-b][1,3]thiazol-5-amine
SMILESCCc1nc2scc(-c3ccccc3)n2c1N
InChIInChI=1S/C13H13N3S/c1-2-10-12(14)16-11(8-17-13(16)15-10)9-6-4-3-5-7-9/h3-8H,2,14H2,1H3
InChIKeyWDLVIEFUPGGJDD-UHFFFAOYSA-N
MW243.34 g/mol
LogP3.21
Rot. Bonds2

About 6-ethyl-3-phenylimidazo[2,1-b][1,3]thiazol-5-amine

6-ethyl-3-phenylimidazo[2,1-b][1,3]thiazol-5-amine (PubChem CID 82372908) has the molecular formula C13H13N3S and a molecular weight of 243.34 g/mol. Its IUPAC name is 6-ethyl-3-phenylimidazo[2,1-b][1,3]thiazol-5-amine.

Molecular Properties

Compound Name6-ethyl-3-phenylimidazo[2,1-b][1,3]thiazol-5-amine
PubChem CID82372908
Molecular FormulaC13H13N3S
Molecular Weight243.34 g/mol
Exact Mass243.08
IUPAC Name6-ethyl-3-phenylimidazo[2,1-b][1,3]thiazol-5-amine
SMILESCCc1nc2scc(-c3ccccc3)n2c1N
InChIInChI=1S/C13H13N3S/c1-2-10-12(14)16-11(8-17-13(16)15-10)9-6-4-3-5-7-9/h3-8H,2,14H2,1H3
InChIKeyWDLVIEFUPGGJDD-UHFFFAOYSA-N
XLogP3.21
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.34
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3,6-diphenylimidazo[2,1-b][1,3]thiazol-5-amine
CID 82068552
6-methyl-3-(4-methylphenyl)imidazo[2,1-b][1,3]thiazol-5-amine
CID 82068565
3-(4-ethylphenyl)-6-(furan-2-yl)imidazo[2,1-b][1,3]thiazol-5-amine
CID 93216173
3,5,6-triphenylimidazo[2,1-b][1,3]thiazole
CID 10760466
3,6-dipyridin-4-ylimidazo[2,1-b][1,3]thiazol-5-amine
CID 82068723
3-methylsulfanyl-5-phenyl-[1,3]thiazolo[2,3-c][1,2,4]triazole
CID 30222922
7-hydroxy-3-phenyl-[1,3]thiazolo[3,2-a]pyrimidin-5-one
CID 135542318
propyl 7-oxo-3-phenyl-[1,3]thiazolo[3,2-a]pyrimidine-5-carboxylate
CID 54545406
5-diethoxyphosphoryl-3,6-diphenylimidazo[2,1-b][1,3]thiazole
CID 132516192
methyl 5-chloro-3-phenylimidazo[2,1-b][1,3]thiazole-6-carboxylate
CID 165492506
3-benzyl-5-phenyl-[1,3]thiazolo[2,3-c][1,2,4]triazole
CID 86260022
3-phenyl-[1,3]thiazolo[2,3-b]quinazolin-5-one
CID 3569212

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-3-phenylimidazo[2,1-b][1,3]thiazol-5-amine?
The IUPAC name of 6-ethyl-3-phenylimidazo[2,1-b][1,3]thiazol-5-amine (CID 82372908) is 6-ethyl-3-phenylimidazo[2,1-b][1,3]thiazol-5-amine.
What is the SMILES notation for 6-ethyl-3-phenylimidazo[2,1-b][1,3]thiazol-5-amine?
The canonical SMILES for 6-ethyl-3-phenylimidazo[2,1-b][1,3]thiazol-5-amine is CCc1nc2scc(-c3ccccc3)n2c1N.
What is the InChIKey of 6-ethyl-3-phenylimidazo[2,1-b][1,3]thiazol-5-amine?
The InChIKey is WDLVIEFUPGGJDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3S/c1-2-10-12(14)16-11(8-17-13(16)15-10)9-6-4-3-5-7-9/h3-8H,2,14H2,1H3.
What are the key properties of 6-ethyl-3-phenylimidazo[2,1-b][1,3]thiazol-5-amine?
6-ethyl-3-phenylimidazo[2,1-b][1,3]thiazol-5-amine has a molecular weight of 243.34 g/mol, XLogP of 3.21, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-3-phenylimidazo[2,1-b][1,3]thiazol-5-amine is sourced from PubChem (CID 82372908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).