[3-(4-propan-2-ylphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]methanamine

C15H17N3S — CID 94697335

IUPAC[3-(4-propan-2-ylphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]methanamine
SMILESCC(C)c1ccc(-c2c(CN)sc3nccn23)cc1
InChIInChI=1S/C15H17N3S/c1-10(2)11-3-5-12(6-4-11)14-13(9-16)19-15-17-7-8-18(14)15/h3-8,10H,9,16H2,1-2H3
InChIKeyQGLBJNKQKUMBDE-UHFFFAOYSA-N
MW271.39 g/mol
LogP3.64
Rot. Bonds3

About [3-(4-propan-2-ylphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]methanamine

[3-(4-propan-2-ylphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]methanamine (PubChem CID 94697335) has the molecular formula C15H17N3S and a molecular weight of 271.39 g/mol. Its IUPAC name is [3-(4-propan-2-ylphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]methanamine.

Molecular Properties

Compound Name[3-(4-propan-2-ylphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]methanamine
PubChem CID94697335
Molecular FormulaC15H17N3S
Molecular Weight271.39 g/mol
Exact Mass271.11
IUPAC Name[3-(4-propan-2-ylphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]methanamine
SMILESCC(C)c1ccc(-c2c(CN)sc3nccn23)cc1
InChIInChI=1S/C15H17N3S/c1-10(2)11-3-5-12(6-4-11)14-13(9-16)19-15-17-7-8-18(14)15/h3-8,10H,9,16H2,1-2H3
InChIKeyQGLBJNKQKUMBDE-UHFFFAOYSA-N
XLogP3.64
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.39
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3-methylimidazo[2,1-b][1,3]thiazol-2-yl)methanamine
CID 82503049
2-[3-(4-fluoro-3-methylphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]ethanamine
CID 94698961
[2-methyl-3-(4-propan-2-ylphenyl)imidazo[2,1-b][1,3]thiazol-6-yl]methanamine
CID 82061892
[4-(4-propan-2-ylphenyl)pyrimidin-2-yl]methanamine
CID 82473712
[5-methyl-4-(4-propan-2-ylphenyl)-1,3-thiazol-2-yl]methanamine
CID 39349446
2-(1-methylimidazol-2-yl)-2-(4-propan-2-ylphenyl)ethanamine
CID 116834930
2-methyl-3-(4-propan-2-ylphenyl)imidazo[2,1-b][1,3]thiazole-6-carboxylic acid
CID 82061889
[5-(4-methylphenyl)-1-(4-propan-2-ylphenyl)triazol-4-yl]methanamine
CID 94938003
[3-(4-propan-2-ylphenyl)-1,2-oxazol-4-yl]methanamine
CID 82284911
[3-methyl-2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridin-8-yl]methanamine
CID 82059845
[3-methyl-2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridin-7-yl]methanamine
CID 82059865
3-ethyl-5-(4-propan-2-ylphenyl)imidazol-4-amine
CID 62016973

Frequently Asked Questions

What is the IUPAC name of [3-(4-propan-2-ylphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]methanamine?
The IUPAC name of [3-(4-propan-2-ylphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]methanamine (CID 94697335) is [3-(4-propan-2-ylphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]methanamine.
What is the SMILES notation for [3-(4-propan-2-ylphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]methanamine?
The canonical SMILES for [3-(4-propan-2-ylphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]methanamine is CC(C)c1ccc(-c2c(CN)sc3nccn23)cc1.
What is the InChIKey of [3-(4-propan-2-ylphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]methanamine?
The InChIKey is QGLBJNKQKUMBDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3S/c1-10(2)11-3-5-12(6-4-11)14-13(9-16)19-15-17-7-8-18(14)15/h3-8,10H,9,16H2,1-2H3.
What are the key properties of [3-(4-propan-2-ylphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]methanamine?
[3-(4-propan-2-ylphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]methanamine has a molecular weight of 271.39 g/mol, XLogP of 3.64, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(4-propan-2-ylphenyl)imidazo[2,1-b][1,3]thiazol-2-yl]methanamine is sourced from PubChem (CID 94697335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).