5-piperazin-1-yl-2-(trifluoromethyl)-1,3-thiazole

C8H10F3N3S — CID 106784018

IUPAC5-piperazin-1-yl-2-(trifluoromethyl)-1,3-thiazole
SMILESFC(F)(F)c1ncc(N2CCNCC2)s1
InChIInChI=1S/C8H10F3N3S/c9-8(10,11)7-13-5-6(15-7)14-3-1-12-2-4-14/h5,12H,1-4H2
InChIKeyAONZNDNBAFNLRC-UHFFFAOYSA-N
MW237.25 g/mol
LogP1.57
Rot. Bonds1

About 5-piperazin-1-yl-2-(trifluoromethyl)-1,3-thiazole

5-piperazin-1-yl-2-(trifluoromethyl)-1,3-thiazole (PubChem CID 106784018) has the molecular formula C8H10F3N3S and a molecular weight of 237.25 g/mol. Its IUPAC name is 5-piperazin-1-yl-2-(trifluoromethyl)-1,3-thiazole.

Molecular Properties

Compound Name5-piperazin-1-yl-2-(trifluoromethyl)-1,3-thiazole
PubChem CID106784018
Molecular FormulaC8H10F3N3S
Molecular Weight237.25 g/mol
Exact Mass237.05
IUPAC Name5-piperazin-1-yl-2-(trifluoromethyl)-1,3-thiazole
SMILESFC(F)(F)c1ncc(N2CCNCC2)s1
InChIInChI=1S/C8H10F3N3S/c9-8(10,11)7-13-5-6(15-7)14-3-1-12-2-4-14/h5,12H,1-4H2
InChIKeyAONZNDNBAFNLRC-UHFFFAOYSA-N
XLogP1.57
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.25
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(Trifluoromethyl)-1,3-thiazol-5-amine hydrochloride
CID 137965841
5-(Piperazin-1-yl)thiazole Dihydrochloride
CID 165809408
2-(Trifluoromethyl)thiazol-5-amine
CID 53403798
2-[1-(Trifluoromethyl)piperazin-2-yl]-1,3-thiazole;hydrochloride
CID 69098575
N-(2-fluoroethyl)-1,3-thiazol-5-amine
CID 91035232
N-(trifluoromethyl)-1,3-thiazol-5-amine
CID 91280141
2-Methyl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]piperidin-4-amine
CID 117721479
5-(4,4-Difluoropiperidin-1-yl)-2-methyl-1,3-thiazole;ethane
CID 142825973
5-(4,4-Difluoropiperidin-1-yl)-2-methyl-1,3-thiazole
CID 142825974
N-methyl-2-(trifluoromethyl)-1,3-thiazol-5-amine
CID 151586026
5-(2,8-Diazaspiro[4.5]decan-2-yl)-2-(trifluoromethyl)-1,3-thiazole
CID 172394757
2-fluoro-N-methyl-1,3-thiazol-5-amine
CID 173035614

Frequently Asked Questions

What is the IUPAC name of 5-piperazin-1-yl-2-(trifluoromethyl)-1,3-thiazole?
The IUPAC name of 5-piperazin-1-yl-2-(trifluoromethyl)-1,3-thiazole (CID 106784018) is 5-piperazin-1-yl-2-(trifluoromethyl)-1,3-thiazole.
What is the SMILES notation for 5-piperazin-1-yl-2-(trifluoromethyl)-1,3-thiazole?
The canonical SMILES for 5-piperazin-1-yl-2-(trifluoromethyl)-1,3-thiazole is FC(F)(F)c1ncc(N2CCNCC2)s1.
What is the InChIKey of 5-piperazin-1-yl-2-(trifluoromethyl)-1,3-thiazole?
The InChIKey is AONZNDNBAFNLRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F3N3S/c9-8(10,11)7-13-5-6(15-7)14-3-1-12-2-4-14/h5,12H,1-4H2.
What are the key properties of 5-piperazin-1-yl-2-(trifluoromethyl)-1,3-thiazole?
5-piperazin-1-yl-2-(trifluoromethyl)-1,3-thiazole has a molecular weight of 237.25 g/mol, XLogP of 1.57, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-piperazin-1-yl-2-(trifluoromethyl)-1,3-thiazole is sourced from PubChem (CID 106784018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).