[3-(2,4,5-trimethylphenyl)imidazo[2,1-b][1,3]thiazol-6-yl]methanamine

C15H17N3S — CID 96668174

IUPAC[3-(2,4,5-trimethylphenyl)imidazo[2,1-b][1,3]thiazol-6-yl]methanamine
SMILESCc1cc(C)c(-c2csc3nc(CN)cn23)cc1C
InChIInChI=1S/C15H17N3S/c1-9-4-11(3)13(5-10(9)2)14-8-19-15-17-12(6-16)7-18(14)15/h4-5,7-8H,6,16H2,1-3H3
InChIKeyQYVLGOWIXNTRCO-UHFFFAOYSA-N
MW271.39 g/mol
LogP3.45
Rot. Bonds2

About [3-(2,4,5-trimethylphenyl)imidazo[2,1-b][1,3]thiazol-6-yl]methanamine

[3-(2,4,5-trimethylphenyl)imidazo[2,1-b][1,3]thiazol-6-yl]methanamine (PubChem CID 96668174) has the molecular formula C15H17N3S and a molecular weight of 271.39 g/mol. Its IUPAC name is [3-(2,4,5-trimethylphenyl)imidazo[2,1-b][1,3]thiazol-6-yl]methanamine.

Molecular Properties

Compound Name[3-(2,4,5-trimethylphenyl)imidazo[2,1-b][1,3]thiazol-6-yl]methanamine
PubChem CID96668174
Molecular FormulaC15H17N3S
Molecular Weight271.39 g/mol
Exact Mass271.11
IUPAC Name[3-(2,4,5-trimethylphenyl)imidazo[2,1-b][1,3]thiazol-6-yl]methanamine
SMILESCc1cc(C)c(-c2csc3nc(CN)cn23)cc1C
InChIInChI=1S/C15H17N3S/c1-9-4-11(3)13(5-10(9)2)14-8-19-15-17-12(6-16)7-18(14)15/h4-5,7-8H,6,16H2,1-3H3
InChIKeyQYVLGOWIXNTRCO-UHFFFAOYSA-N
XLogP3.45
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.39
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(2,4,5-trimethylphenyl)imidazo[2,1-b][1,3]thiazol-6-amine
CID 82483165
[3-(5-fluoro-2-methoxyphenyl)imidazo[2,1-b][1,3]thiazol-6-yl]methanamine
CID 98020701
[3-(4-methylthiadiazol-5-yl)imidazo[2,1-b][1,3]thiazol-6-yl]methanamine
CID 82382480
6-(chloromethyl)-3-(2,4-dimethylphenyl)imidazo[2,1-b][1,3]thiazole
CID 82061936
3-(4,5-dimethoxy-2-methylphenyl)imidazo[2,1-b][1,3]thiazole-6-carboxylic acid
CID 4685203
[2-(2,4,5-trimethylphenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-yl]methanamine
CID 96668676
3-(2,4-dimethylphenyl)imidazo[2,1-b][1,3]thiazole-6-carboxylic acid
CID 4263024
5-(2,4,5-trimethylphenyl)-[1,3]thiazolo[2,3-c][1,2,4]triazol-3-amine
CID 82483652
2-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)ethanamine;hydrochloride
CID 53396521
[3-(2,4-dimethylphenyl)-2-methylimidazo[2,1-b][1,3]thiazol-6-yl]methanamine
CID 82061943
3-(4-ethoxy-2-methylphenyl)imidazo[2,1-b][1,3]thiazole-6-carboxylic acid
CID 4566367
3-(2,5-dimethoxyphenyl)imidazo[2,1-b][1,3]thiazole-6-carboxylic acid
CID 3571662

Frequently Asked Questions

What is the IUPAC name of [3-(2,4,5-trimethylphenyl)imidazo[2,1-b][1,3]thiazol-6-yl]methanamine?
The IUPAC name of [3-(2,4,5-trimethylphenyl)imidazo[2,1-b][1,3]thiazol-6-yl]methanamine (CID 96668174) is [3-(2,4,5-trimethylphenyl)imidazo[2,1-b][1,3]thiazol-6-yl]methanamine.
What is the SMILES notation for [3-(2,4,5-trimethylphenyl)imidazo[2,1-b][1,3]thiazol-6-yl]methanamine?
The canonical SMILES for [3-(2,4,5-trimethylphenyl)imidazo[2,1-b][1,3]thiazol-6-yl]methanamine is Cc1cc(C)c(-c2csc3nc(CN)cn23)cc1C.
What is the InChIKey of [3-(2,4,5-trimethylphenyl)imidazo[2,1-b][1,3]thiazol-6-yl]methanamine?
The InChIKey is QYVLGOWIXNTRCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3S/c1-9-4-11(3)13(5-10(9)2)14-8-19-15-17-12(6-16)7-18(14)15/h4-5,7-8H,6,16H2,1-3H3.
What are the key properties of [3-(2,4,5-trimethylphenyl)imidazo[2,1-b][1,3]thiazol-6-yl]methanamine?
[3-(2,4,5-trimethylphenyl)imidazo[2,1-b][1,3]thiazol-6-yl]methanamine has a molecular weight of 271.39 g/mol, XLogP of 3.45, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2,4,5-trimethylphenyl)imidazo[2,1-b][1,3]thiazol-6-yl]methanamine is sourced from PubChem (CID 96668174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).