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

C8H11N3S — CID 42647348

IUPAC2-(2-methylimidazo[2,1-b][1,3]thiazol-6-yl)ethanamine
SMILESCc1cn2cc(CCN)nc2s1
InChIInChI=1S/C8H11N3S/c1-6-4-11-5-7(2-3-9)10-8(11)12-6/h4-5H,2-3,9H2,1H3
InChIKeyXXROGQJSTZKFFV-UHFFFAOYSA-N
MW181.26 g/mol
LogP1.21
Rot. Bonds2

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

2-(2-methylimidazo[2,1-b][1,3]thiazol-6-yl)ethanamine (PubChem CID 42647348) has the molecular formula C8H11N3S and a molecular weight of 181.26 g/mol. Its IUPAC name is 2-(2-methylimidazo[2,1-b][1,3]thiazol-6-yl)ethanamine.

Molecular Properties

Compound Name2-(2-methylimidazo[2,1-b][1,3]thiazol-6-yl)ethanamine
PubChem CID42647348
Molecular FormulaC8H11N3S
Molecular Weight181.26 g/mol
Exact Mass181.07
IUPAC Name2-(2-methylimidazo[2,1-b][1,3]thiazol-6-yl)ethanamine
SMILESCc1cn2cc(CCN)nc2s1
InChIInChI=1S/C8H11N3S/c1-6-4-11-5-7(2-3-9)10-8(11)12-6/h4-5H,2-3,9H2,1H3
InChIKeyXXROGQJSTZKFFV-UHFFFAOYSA-N
XLogP1.21
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.26
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methylimidazo[2,1-b][1,3]thiazol-6-yl)ethanamine?
The IUPAC name of 2-(2-methylimidazo[2,1-b][1,3]thiazol-6-yl)ethanamine (CID 42647348) is 2-(2-methylimidazo[2,1-b][1,3]thiazol-6-yl)ethanamine.
What is the SMILES notation for 2-(2-methylimidazo[2,1-b][1,3]thiazol-6-yl)ethanamine?
The canonical SMILES for 2-(2-methylimidazo[2,1-b][1,3]thiazol-6-yl)ethanamine is Cc1cn2cc(CCN)nc2s1.
What is the InChIKey of 2-(2-methylimidazo[2,1-b][1,3]thiazol-6-yl)ethanamine?
The InChIKey is XXROGQJSTZKFFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3S/c1-6-4-11-5-7(2-3-9)10-8(11)12-6/h4-5H,2-3,9H2,1H3.
What are the key properties of 2-(2-methylimidazo[2,1-b][1,3]thiazol-6-yl)ethanamine?
2-(2-methylimidazo[2,1-b][1,3]thiazol-6-yl)ethanamine has a molecular weight of 181.26 g/mol, XLogP of 1.21, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylimidazo[2,1-b][1,3]thiazol-6-yl)ethanamine is sourced from PubChem (CID 42647348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).