(6-ethylimidazo[2,1-b][1,3]thiazol-5-yl)methanamine

C8H11N3S — CID 82503893

IUPAC(6-ethylimidazo[2,1-b][1,3]thiazol-5-yl)methanamine
SMILESCCc1nc2sccn2c1CN
InChIInChI=1S/C8H11N3S/c1-2-6-7(5-9)11-3-4-12-8(11)10-6/h3-4H,2,5,9H2,1H3
InChIKeyMCHGSBQTYMFHTM-UHFFFAOYSA-N
MW181.26 g/mol
LogP1.42
Rot. Bonds2

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

(6-ethylimidazo[2,1-b][1,3]thiazol-5-yl)methanamine (PubChem CID 82503893) has the molecular formula C8H11N3S and a molecular weight of 181.26 g/mol. Its IUPAC name is (6-ethylimidazo[2,1-b][1,3]thiazol-5-yl)methanamine.

Molecular Properties

Compound Name(6-ethylimidazo[2,1-b][1,3]thiazol-5-yl)methanamine
PubChem CID82503893
Molecular FormulaC8H11N3S
Molecular Weight181.26 g/mol
Exact Mass181.07
IUPAC Name(6-ethylimidazo[2,1-b][1,3]thiazol-5-yl)methanamine
SMILESCCc1nc2sccn2c1CN
InChIInChI=1S/C8H11N3S/c1-2-6-7(5-9)11-3-4-12-8(11)10-6/h3-4H,2,5,9H2,1H3
InChIKeyMCHGSBQTYMFHTM-UHFFFAOYSA-N
XLogP1.42
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 ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (6-ethylimidazo[2,1-b][1,3]thiazol-5-yl)methanamine?
The IUPAC name of (6-ethylimidazo[2,1-b][1,3]thiazol-5-yl)methanamine (CID 82503893) is (6-ethylimidazo[2,1-b][1,3]thiazol-5-yl)methanamine.
What is the SMILES notation for (6-ethylimidazo[2,1-b][1,3]thiazol-5-yl)methanamine?
The canonical SMILES for (6-ethylimidazo[2,1-b][1,3]thiazol-5-yl)methanamine is CCc1nc2sccn2c1CN.
What is the InChIKey of (6-ethylimidazo[2,1-b][1,3]thiazol-5-yl)methanamine?
The InChIKey is MCHGSBQTYMFHTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3S/c1-2-6-7(5-9)11-3-4-12-8(11)10-6/h3-4H,2,5,9H2,1H3.
What are the key properties of (6-ethylimidazo[2,1-b][1,3]thiazol-5-yl)methanamine?
(6-ethylimidazo[2,1-b][1,3]thiazol-5-yl)methanamine has a molecular weight of 181.26 g/mol, XLogP of 1.42, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (6-ethylimidazo[2,1-b][1,3]thiazol-5-yl)methanamine is sourced from PubChem (CID 82503893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).