2-(2-thiophen-2-ylpyrrolidin-1-yl)-3-(trifluoromethyl)pyridine

C14H13F3N2S — CID 55635999

IUPAC2-(2-thiophen-2-ylpyrrolidin-1-yl)-3-(trifluoromethyl)pyridine
SMILESFC(F)(F)c1cccnc1N1CCCC1c1cccs1
InChIInChI=1S/C14H13F3N2S/c15-14(16,17)10-4-1-7-18-13(10)19-8-2-5-11(19)12-6-3-9-20-12/h1,3-4,6-7,9,11H,2,5,8H2
InChIKeyNUKPGJUYKONMRE-UHFFFAOYSA-N
MW298.33 g/mol
LogP4.50
Rot. Bonds2

About 2-(2-thiophen-2-ylpyrrolidin-1-yl)-3-(trifluoromethyl)pyridine

2-(2-thiophen-2-ylpyrrolidin-1-yl)-3-(trifluoromethyl)pyridine (PubChem CID 55635999) has the molecular formula C14H13F3N2S and a molecular weight of 298.33 g/mol. Its IUPAC name is 2-(2-thiophen-2-ylpyrrolidin-1-yl)-3-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name2-(2-thiophen-2-ylpyrrolidin-1-yl)-3-(trifluoromethyl)pyridine
PubChem CID55635999
Molecular FormulaC14H13F3N2S
Molecular Weight298.33 g/mol
Exact Mass298.08
IUPAC Name2-(2-thiophen-2-ylpyrrolidin-1-yl)-3-(trifluoromethyl)pyridine
SMILESFC(F)(F)c1cccnc1N1CCCC1c1cccs1
InChIInChI=1S/C14H13F3N2S/c15-14(16,17)10-4-1-7-18-13(10)19-8-2-5-11(19)12-6-3-9-20-12/h1,3-4,6-7,9,11H,2,5,8H2
InChIKeyNUKPGJUYKONMRE-UHFFFAOYSA-N
XLogP4.50
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.33
LogP ≤ 54.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-(2-thiophen-2-ylpyrrolidin-1-yl)-3-(trifluoromethyl)pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[(2S)-2-thiophen-2-ylpyrrolidin-1-yl]-4-(trifluoromethyl)pyrimidine
CID 97012968
3-methyl-5-[2-[(2S)-2-thiophen-2-ylpyrrolidin-1-yl]-3-pyridinyl]-1,2,4-oxadiazole
CID 97217841
2-[(2R)-2-methylpiperidin-1-yl]-3-(trifluoromethyl)pyridine
CID 125486842
(2S)-1-[3-(trifluoromethyl)-2-pyridinyl]pyrrolidine-2-carboxylic acid
CID 28873916
2-(2-thiophen-2-ylpyrrolidin-1-yl)-5-(trifluoromethoxy)pyridine
CID 133488469
3-(2-hydroxyethyl)-2-[1-[3-(trifluoromethyl)-2-pyridinyl]pyrrolidin-2-yl]quinazolin-4-one
CID 126950790
1-[1-[3-(trifluoromethyl)-2-pyridinyl]piperidin-4-yl]pyrrolidin-2-one
CID 56872917
2-(4-chloropiperidin-1-yl)-3-(trifluoromethyl)pyridine
CID 63388486
2-methoxy-4,6-bis[(2S)-2-thiophen-2-ylpyrrolidin-1-yl]-1,3,5-triazine
CID 124865996
6-pyridin-4-yl-2-[[1-[3-(trifluoromethyl)-2-pyridinyl]pyrrolidin-2-yl]methyl]pyridazin-3-one
CID 126926087
3-tert-butyl-6-(2-thiophen-2-ylpyrrolidin-1-yl)-[1,2,4]triazolo[4,3-b]pyridazine
CID 133488467
1-methyl-4-nitro-5-(2-thiophen-2-ylpyrrolidin-1-yl)imidazole
CID 47121042

Frequently Asked Questions

What is the IUPAC name of 2-(2-thiophen-2-ylpyrrolidin-1-yl)-3-(trifluoromethyl)pyridine?
The IUPAC name of 2-(2-thiophen-2-ylpyrrolidin-1-yl)-3-(trifluoromethyl)pyridine (CID 55635999) is 2-(2-thiophen-2-ylpyrrolidin-1-yl)-3-(trifluoromethyl)pyridine.
What is the SMILES notation for 2-(2-thiophen-2-ylpyrrolidin-1-yl)-3-(trifluoromethyl)pyridine?
The canonical SMILES for 2-(2-thiophen-2-ylpyrrolidin-1-yl)-3-(trifluoromethyl)pyridine is FC(F)(F)c1cccnc1N1CCCC1c1cccs1.
What is the InChIKey of 2-(2-thiophen-2-ylpyrrolidin-1-yl)-3-(trifluoromethyl)pyridine?
The InChIKey is NUKPGJUYKONMRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13F3N2S/c15-14(16,17)10-4-1-7-18-13(10)19-8-2-5-11(19)12-6-3-9-20-12/h1,3-4,6-7,9,11H,2,5,8H2.
What are the key properties of 2-(2-thiophen-2-ylpyrrolidin-1-yl)-3-(trifluoromethyl)pyridine?
2-(2-thiophen-2-ylpyrrolidin-1-yl)-3-(trifluoromethyl)pyridine has a molecular weight of 298.33 g/mol, XLogP of 4.50, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-thiophen-2-ylpyrrolidin-1-yl)-3-(trifluoromethyl)pyridine is sourced from PubChem (CID 55635999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).