2-[3-(2,4-dimethylphenyl)-2-methyl-6-propan-2-ylimidazo[2,1-b][1,3]thiazol-5-yl]ethanamine

C19H25N3S — CID 82062599

IUPAC2-[3-(2,4-dimethylphenyl)-2-methyl-6-propan-2-ylimidazo[2,1-b][1,3]thiazol-5-yl]ethanamine
SMILESCc1ccc(-c2c(C)sc3nc(C(C)C)c(CCN)n23)c(C)c1
InChIInChI=1S/C19H25N3S/c1-11(2)17-16(8-9-20)22-18(14(5)23-19(22)21-17)15-7-6-12(3)10-13(15)4/h6-7,10-11H,8-9,20H2,1-5H3
InChIKeyHURCUCCEDAEKGF-UHFFFAOYSA-N
MW327.50 g/mol
LogP4.61
Rot. Bonds4

About 2-[3-(2,4-dimethylphenyl)-2-methyl-6-propan-2-ylimidazo[2,1-b][1,3]thiazol-5-yl]ethanamine

2-[3-(2,4-dimethylphenyl)-2-methyl-6-propan-2-ylimidazo[2,1-b][1,3]thiazol-5-yl]ethanamine (PubChem CID 82062599) has the molecular formula C19H25N3S and a molecular weight of 327.50 g/mol. Its IUPAC name is 2-[3-(2,4-dimethylphenyl)-2-methyl-6-propan-2-ylimidazo[2,1-b][1,3]thiazol-5-yl]ethanamine.

Molecular Properties

Compound Name2-[3-(2,4-dimethylphenyl)-2-methyl-6-propan-2-ylimidazo[2,1-b][1,3]thiazol-5-yl]ethanamine
PubChem CID82062599
Molecular FormulaC19H25N3S
Molecular Weight327.50 g/mol
Exact Mass327.18
IUPAC Name2-[3-(2,4-dimethylphenyl)-2-methyl-6-propan-2-ylimidazo[2,1-b][1,3]thiazol-5-yl]ethanamine
SMILESCc1ccc(-c2c(C)sc3nc(C(C)C)c(CCN)n23)c(C)c1
InChIInChI=1S/C19H25N3S/c1-11(2)17-16(8-9-20)22-18(14(5)23-19(22)21-17)15-7-6-12(3)10-13(15)4/h6-7,10-11H,8-9,20H2,1-5H3
InChIKeyHURCUCCEDAEKGF-UHFFFAOYSA-N
XLogP4.61
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.50
LogP ≤ 54.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[3-(2,4-dimethylphenyl)-2-methylimidazo[2,1-b][1,3]thiazol-6-yl]methanamine
CID 82061943
2-[3-(2-methoxyphenyl)-2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl]ethanamine
CID 39195038
3-(2,4-dimethylphenyl)-2-methyl-6-propylimidazo[2,1-b][1,3]thiazole-5-carboxylic acid
CID 82035392
2-[3-(4-chlorophenyl)-2,6-dimethylimidazo[2,1-b][1,3]thiazol-5-yl]ethanamine
CID 39195012
2-[2-(2,4-dimethylphenyl)-8-fluoroimidazo[1,2-a]pyridin-3-yl]ethanamine
CID 82529736
2-[3-(4-fluorophenyl)-6-propan-2-ylimidazo[2,1-b][1,3]thiazol-5-yl]ethanamine
CID 82062511
2-[6-(2-ethoxyphenyl)-3-ethyl-2-methylimidazo[2,1-b][1,3]thiazol-5-yl]ethanamine
CID 82062739
2-[5-(2,4-dimethylphenyl)-1,2,4-oxadiazol-3-yl]ethanamine
CID 61334501
3-(2,4-dimethylphenyl)-2-ethyl-6-methylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde
CID 39198955
6-(2,4-dimethylphenyl)-5-ethyl-3-methylimidazo[2,1-b][1,3]thiazole-2-carboxylic acid
CID 92914143
2-[4-(2,4-dimethylphenyl)-2-methyl-1H-imidazol-5-yl]ethanamine
CID 82288567
4-(2,4-dimethylphenyl)-1-methyl-3-propan-2-ylpyrazol-5-amine
CID 83544738

Frequently Asked Questions

What is the IUPAC name of 2-[3-(2,4-dimethylphenyl)-2-methyl-6-propan-2-ylimidazo[2,1-b][1,3]thiazol-5-yl]ethanamine?
The IUPAC name of 2-[3-(2,4-dimethylphenyl)-2-methyl-6-propan-2-ylimidazo[2,1-b][1,3]thiazol-5-yl]ethanamine (CID 82062599) is 2-[3-(2,4-dimethylphenyl)-2-methyl-6-propan-2-ylimidazo[2,1-b][1,3]thiazol-5-yl]ethanamine.
What is the SMILES notation for 2-[3-(2,4-dimethylphenyl)-2-methyl-6-propan-2-ylimidazo[2,1-b][1,3]thiazol-5-yl]ethanamine?
The canonical SMILES for 2-[3-(2,4-dimethylphenyl)-2-methyl-6-propan-2-ylimidazo[2,1-b][1,3]thiazol-5-yl]ethanamine is Cc1ccc(-c2c(C)sc3nc(C(C)C)c(CCN)n23)c(C)c1.
What is the InChIKey of 2-[3-(2,4-dimethylphenyl)-2-methyl-6-propan-2-ylimidazo[2,1-b][1,3]thiazol-5-yl]ethanamine?
The InChIKey is HURCUCCEDAEKGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3S/c1-11(2)17-16(8-9-20)22-18(14(5)23-19(22)21-17)15-7-6-12(3)10-13(15)4/h6-7,10-11H,8-9,20H2,1-5H3.
What are the key properties of 2-[3-(2,4-dimethylphenyl)-2-methyl-6-propan-2-ylimidazo[2,1-b][1,3]thiazol-5-yl]ethanamine?
2-[3-(2,4-dimethylphenyl)-2-methyl-6-propan-2-ylimidazo[2,1-b][1,3]thiazol-5-yl]ethanamine has a molecular weight of 327.50 g/mol, XLogP of 4.61, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(2,4-dimethylphenyl)-2-methyl-6-propan-2-ylimidazo[2,1-b][1,3]thiazol-5-yl]ethanamine is sourced from PubChem (CID 82062599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).