2,2,2-trifluoro-N-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine

C9H10F3N3S — CID 43755053

IUPAC2,2,2-trifluoro-N-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine
SMILESCc1nc2sccn2c1CNCC(F)(F)F
InChIInChI=1S/C9H10F3N3S/c1-6-7(4-13-5-9(10,11)12)15-2-3-16-8(15)14-6/h2-3,13H,4-5H2,1H3
InChIKeySJUQOQRZGKPTRL-UHFFFAOYSA-N
MW249.26 g/mol
LogP2.36
Rot. Bonds3

About 2,2,2-trifluoro-N-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine

2,2,2-trifluoro-N-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine (PubChem CID 43755053) has the molecular formula C9H10F3N3S and a molecular weight of 249.26 g/mol. Its IUPAC name is 2,2,2-trifluoro-N-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine.

Molecular Properties

Compound Name2,2,2-trifluoro-N-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine
PubChem CID43755053
Molecular FormulaC9H10F3N3S
Molecular Weight249.26 g/mol
Exact Mass249.05
IUPAC Name2,2,2-trifluoro-N-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine
SMILESCc1nc2sccn2c1CNCC(F)(F)F
InChIInChI=1S/C9H10F3N3S/c1-6-7(4-13-5-9(10,11)12)15-2-3-16-8(15)14-6/h2-3,13H,4-5H2,1H3
InChIKeySJUQOQRZGKPTRL-UHFFFAOYSA-N
XLogP2.36
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.26
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,2,2-trifluoro-N-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine?
The IUPAC name of 2,2,2-trifluoro-N-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine (CID 43755053) is 2,2,2-trifluoro-N-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine.
What is the SMILES notation for 2,2,2-trifluoro-N-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine?
The canonical SMILES for 2,2,2-trifluoro-N-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine is Cc1nc2sccn2c1CNCC(F)(F)F.
What is the InChIKey of 2,2,2-trifluoro-N-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine?
The InChIKey is SJUQOQRZGKPTRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10F3N3S/c1-6-7(4-13-5-9(10,11)12)15-2-3-16-8(15)14-6/h2-3,13H,4-5H2,1H3.
What are the key properties of 2,2,2-trifluoro-N-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine?
2,2,2-trifluoro-N-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine has a molecular weight of 249.26 g/mol, XLogP of 2.36, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,2-trifluoro-N-[(6-methylimidazo[2,1-b][1,3]thiazol-5-yl)methyl]ethanamine is sourced from PubChem (CID 43755053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).