5-(2-aminopropyl)-N-methyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazol-6-amine

C11H15F3N4S — CID 63795015

IUPAC5-(2-aminopropyl)-N-methyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazol-6-amine
SMILESCC(N)Cc1c(N(C)CC(F)(F)F)nc2sccn12
InChIInChI=1S/C11H15F3N4S/c1-7(15)5-8-9(17(2)6-11(12,13)14)16-10-18(8)3-4-19-10/h3-4,7H,5-6,15H2,1-2H3
InChIKeyFACUZDGYSAGARY-UHFFFAOYSA-N
MW292.33 g/mol
LogP2.28
Rot. Bonds4

About 5-(2-aminopropyl)-N-methyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazol-6-amine

5-(2-aminopropyl)-N-methyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazol-6-amine (PubChem CID 63795015) has the molecular formula C11H15F3N4S and a molecular weight of 292.33 g/mol. Its IUPAC name is 5-(2-aminopropyl)-N-methyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazol-6-amine.

Molecular Properties

Compound Name5-(2-aminopropyl)-N-methyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazol-6-amine
PubChem CID63795015
Molecular FormulaC11H15F3N4S
Molecular Weight292.33 g/mol
Exact Mass292.10
IUPAC Name5-(2-aminopropyl)-N-methyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazol-6-amine
SMILESCC(N)Cc1c(N(C)CC(F)(F)F)nc2sccn12
InChIInChI=1S/C11H15F3N4S/c1-7(15)5-8-9(17(2)6-11(12,13)14)16-10-18(8)3-4-19-10/h3-4,7H,5-6,15H2,1-2H3
InChIKeyFACUZDGYSAGARY-UHFFFAOYSA-N
XLogP2.28
TPSA46.56 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.33
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(2-aminopropyl)-N-methyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazol-6-amine?
The IUPAC name of 5-(2-aminopropyl)-N-methyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazol-6-amine (CID 63795015) is 5-(2-aminopropyl)-N-methyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazol-6-amine.
What is the SMILES notation for 5-(2-aminopropyl)-N-methyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazol-6-amine?
The canonical SMILES for 5-(2-aminopropyl)-N-methyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazol-6-amine is CC(N)Cc1c(N(C)CC(F)(F)F)nc2sccn12.
What is the InChIKey of 5-(2-aminopropyl)-N-methyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazol-6-amine?
The InChIKey is FACUZDGYSAGARY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15F3N4S/c1-7(15)5-8-9(17(2)6-11(12,13)14)16-10-18(8)3-4-19-10/h3-4,7H,5-6,15H2,1-2H3.
What are the key properties of 5-(2-aminopropyl)-N-methyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazol-6-amine?
5-(2-aminopropyl)-N-methyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazol-6-amine has a molecular weight of 292.33 g/mol, XLogP of 2.28, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-aminopropyl)-N-methyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazol-6-amine is sourced from PubChem (CID 63795015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).