3-pyrrolidin-3-yl-5-(trifluoromethyl)pyridine

C10H11F3N2 — CID 71250619

IUPAC3-pyrrolidin-3-yl-5-(trifluoromethyl)pyridine
SMILESFC(F)(F)c1cncc(C2CCNC2)c1
InChIInChI=1S/C10H11F3N2/c11-10(12,13)9-3-8(5-15-6-9)7-1-2-14-4-7/h3,5-7,14H,1-2,4H2
InChIKeyBCZJABVEZTWQGZ-UHFFFAOYSA-N
MW216.21 g/mol
LogP2.18
Rot. Bonds1

About 3-pyrrolidin-3-yl-5-(trifluoromethyl)pyridine

3-pyrrolidin-3-yl-5-(trifluoromethyl)pyridine (PubChem CID 71250619) has the molecular formula C10H11F3N2 and a molecular weight of 216.21 g/mol. Its IUPAC name is 3-pyrrolidin-3-yl-5-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name3-pyrrolidin-3-yl-5-(trifluoromethyl)pyridine
PubChem CID71250619
Molecular FormulaC10H11F3N2
Molecular Weight216.21 g/mol
Exact Mass216.09
IUPAC Name3-pyrrolidin-3-yl-5-(trifluoromethyl)pyridine
SMILESFC(F)(F)c1cncc(C2CCNC2)c1
InChIInChI=1S/C10H11F3N2/c11-10(12,13)9-3-8(5-15-6-9)7-1-2-14-4-7/h3,5-7,14H,1-2,4H2
InChIKeyBCZJABVEZTWQGZ-UHFFFAOYSA-N
XLogP2.18
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.21
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3S)-3-[4-(trifluoromethyl)phenyl]pyrrolidine
CID 71742225
(3S)-3-[4-(trifluoromethyl)phenyl]pyrrolidine;hydrochloride
CID 71742224
3-methyl-5-[(3S)-pyrrolidin-3-yl]pyridine
CID 96736316
3-[(2S)-piperidin-2-yl]-5-(trifluoromethyl)pyridine
CID 131397807
5-pyrrolidin-3-ylpyrimidine
CID 66996535
3-[3,5-bis(trifluoromethyl)phenyl]piperidine
CID 45073834
(3R)-3-[4-(trifluoromethyl)phenyl]piperidine;hydrochloride
CID 45074264
(3S)-3-[4-(trifluoromethyl)phenyl]piperidine;hydrochloride
CID 45074262
CID 156632351
CID 156632351
2-pyrrolidin-3-yl-5-(trifluoromethyl)pyridine;hydrochloride
CID 171371651
3-pyrrolidin-3-ylpyridine
CID 3613651
5-pyrrolidin-3-yl-2-(trifluoromethoxy)pyridine
CID 169498534

Frequently Asked Questions

What is the IUPAC name of 3-pyrrolidin-3-yl-5-(trifluoromethyl)pyridine?
The IUPAC name of 3-pyrrolidin-3-yl-5-(trifluoromethyl)pyridine (CID 71250619) is 3-pyrrolidin-3-yl-5-(trifluoromethyl)pyridine.
What is the SMILES notation for 3-pyrrolidin-3-yl-5-(trifluoromethyl)pyridine?
The canonical SMILES for 3-pyrrolidin-3-yl-5-(trifluoromethyl)pyridine is FC(F)(F)c1cncc(C2CCNC2)c1.
What is the InChIKey of 3-pyrrolidin-3-yl-5-(trifluoromethyl)pyridine?
The InChIKey is BCZJABVEZTWQGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F3N2/c11-10(12,13)9-3-8(5-15-6-9)7-1-2-14-4-7/h3,5-7,14H,1-2,4H2.
What are the key properties of 3-pyrrolidin-3-yl-5-(trifluoromethyl)pyridine?
3-pyrrolidin-3-yl-5-(trifluoromethyl)pyridine has a molecular weight of 216.21 g/mol, XLogP of 2.18, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pyrrolidin-3-yl-5-(trifluoromethyl)pyridine is sourced from PubChem (CID 71250619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).