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

C11H15F3N2S — CID 106783401

IUPAC5-(2-propylpyrrolidin-2-yl)-2-(trifluoromethyl)-1,3-thiazole
SMILESCCCC1(c2cnc(C(F)(F)F)s2)CCCN1
InChIInChI=1S/C11H15F3N2S/c1-2-4-10(5-3-6-16-10)8-7-15-9(17-8)11(12,13)14/h7,16H,2-6H2,1H3
InChIKeyPPSGZEFJKMGRGQ-UHFFFAOYSA-N
MW264.32 g/mol
LogP3.54
Rot. Bonds3

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

5-(2-propylpyrrolidin-2-yl)-2-(trifluoromethyl)-1,3-thiazole (PubChem CID 106783401) has the molecular formula C11H15F3N2S and a molecular weight of 264.32 g/mol. Its IUPAC name is 5-(2-propylpyrrolidin-2-yl)-2-(trifluoromethyl)-1,3-thiazole.

Molecular Properties

Compound Name5-(2-propylpyrrolidin-2-yl)-2-(trifluoromethyl)-1,3-thiazole
PubChem CID106783401
Molecular FormulaC11H15F3N2S
Molecular Weight264.32 g/mol
Exact Mass264.09
IUPAC Name5-(2-propylpyrrolidin-2-yl)-2-(trifluoromethyl)-1,3-thiazole
SMILESCCCC1(c2cnc(C(F)(F)F)s2)CCCN1
InChIInChI=1S/C11H15F3N2S/c1-2-4-10(5-3-6-16-10)8-7-15-9(17-8)11(12,13)14/h7,16H,2-6H2,1H3
InChIKeyPPSGZEFJKMGRGQ-UHFFFAOYSA-N
XLogP3.54
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-propylpyrrolidin-2-yl)-5-(trifluoromethyl)-1,3-benzothiazole
CID 106977815
2-(5-methylthiophen-2-yl)-2-propylazepane
CID 79117017
2-(2-fluorophenyl)-2-propylpyrrolidine
CID 66468299
1-methyl-2-(2-propylpyrrolidin-2-yl)imidazole
CID 66467396
3-(2-propylpyrrolidin-2-yl)pyridine
CID 66468075
4-ethyl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]cycloheptan-1-amine
CID 106782385
2-propyl-2-thiophen-2-ylazepane
CID 79116814
2-ethyl-2-methyl-4-[2-(trifluoromethyl)-1,3-thiazol-5-yl]oxan-4-ol
CID 106782121
2-[4-fluoro-3-(trifluoromethyl)phenyl]-2-propylazepane
CID 107289102
2-methoxy-3-(2-propylpyrrolidin-2-yl)pyrazine
CID 104515792
2-propyl-2-(2,3,4-trifluorophenyl)pyrrolidine
CID 66465348
2-phenyl-2-propylazepane
CID 79117631

Frequently Asked Questions

What is the IUPAC name of 5-(2-propylpyrrolidin-2-yl)-2-(trifluoromethyl)-1,3-thiazole?
The IUPAC name of 5-(2-propylpyrrolidin-2-yl)-2-(trifluoromethyl)-1,3-thiazole (CID 106783401) is 5-(2-propylpyrrolidin-2-yl)-2-(trifluoromethyl)-1,3-thiazole.
What is the SMILES notation for 5-(2-propylpyrrolidin-2-yl)-2-(trifluoromethyl)-1,3-thiazole?
The canonical SMILES for 5-(2-propylpyrrolidin-2-yl)-2-(trifluoromethyl)-1,3-thiazole is CCCC1(c2cnc(C(F)(F)F)s2)CCCN1.
What is the InChIKey of 5-(2-propylpyrrolidin-2-yl)-2-(trifluoromethyl)-1,3-thiazole?
The InChIKey is PPSGZEFJKMGRGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15F3N2S/c1-2-4-10(5-3-6-16-10)8-7-15-9(17-8)11(12,13)14/h7,16H,2-6H2,1H3.
What are the key properties of 5-(2-propylpyrrolidin-2-yl)-2-(trifluoromethyl)-1,3-thiazole?
5-(2-propylpyrrolidin-2-yl)-2-(trifluoromethyl)-1,3-thiazole has a molecular weight of 264.32 g/mol, XLogP of 3.54, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-propylpyrrolidin-2-yl)-2-(trifluoromethyl)-1,3-thiazole is sourced from PubChem (CID 106783401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).