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

C11H15F3N4S — CID 55008729

IUPAC5-(aminomethyl)-N-propyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazol-6-amine
SMILESCCCN(CC(F)(F)F)c1nc2sccn2c1CN
InChIInChI=1S/C11H15F3N4S/c1-2-3-17(7-11(12,13)14)9-8(6-15)18-4-5-19-10(18)16-9/h4-5H,2-3,6-7,15H2,1H3
InChIKeyIWCDPNPFWWTZMR-UHFFFAOYSA-N
MW292.33 g/mol
LogP2.63
Rot. Bonds5

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

5-(aminomethyl)-N-propyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazol-6-amine (PubChem CID 55008729) has the molecular formula C11H15F3N4S and a molecular weight of 292.33 g/mol. Its IUPAC name is 5-(aminomethyl)-N-propyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazol-6-amine.

Molecular Properties

Compound Name5-(aminomethyl)-N-propyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazol-6-amine
PubChem CID55008729
Molecular FormulaC11H15F3N4S
Molecular Weight292.33 g/mol
Exact Mass292.10
IUPAC Name5-(aminomethyl)-N-propyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazol-6-amine
SMILESCCCN(CC(F)(F)F)c1nc2sccn2c1CN
InChIInChI=1S/C11H15F3N4S/c1-2-3-17(7-11(12,13)14)9-8(6-15)18-4-5-19-10(18)16-9/h4-5H,2-3,6-7,15H2,1H3
InChIKeyIWCDPNPFWWTZMR-UHFFFAOYSA-N
XLogP2.63
TPSA46.56 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.33
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-N-propyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazol-6-amine?
The IUPAC name of 5-(aminomethyl)-N-propyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazol-6-amine (CID 55008729) is 5-(aminomethyl)-N-propyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazol-6-amine.
What is the SMILES notation for 5-(aminomethyl)-N-propyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazol-6-amine?
The canonical SMILES for 5-(aminomethyl)-N-propyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazol-6-amine is CCCN(CC(F)(F)F)c1nc2sccn2c1CN.
What is the InChIKey of 5-(aminomethyl)-N-propyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazol-6-amine?
The InChIKey is IWCDPNPFWWTZMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15F3N4S/c1-2-3-17(7-11(12,13)14)9-8(6-15)18-4-5-19-10(18)16-9/h4-5H,2-3,6-7,15H2,1H3.
What are the key properties of 5-(aminomethyl)-N-propyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazol-6-amine?
5-(aminomethyl)-N-propyl-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 2.63, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-N-propyl-N-(2,2,2-trifluoroethyl)imidazo[2,1-b][1,3]thiazol-6-amine is sourced from PubChem (CID 55008729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).