2-pyrrolidin-3-yl-5-(trifluoromethyl)pyridine;hydrochloride

C10H12ClF3N2 — CID 171371651

IUPAC2-pyrrolidin-3-yl-5-(trifluoromethyl)pyridine;hydrochloride
SMILESCl.FC(F)(F)c1ccc(C2CCNC2)nc1
InChIInChI=1S/C10H11F3N2.ClH/c11-10(12,13)8-1-2-9(15-6-8)7-3-4-14-5-7;/h1-2,6-7,14H,3-5H2;1H
InChIKeyAJMDEFDLMBZSIN-UHFFFAOYSA-N
MW252.67 g/mol
LogP2.60
Rot. Bonds1

About 2-pyrrolidin-3-yl-5-(trifluoromethyl)pyridine;hydrochloride

2-pyrrolidin-3-yl-5-(trifluoromethyl)pyridine;hydrochloride (PubChem CID 171371651) has the molecular formula C10H12ClF3N2 and a molecular weight of 252.67 g/mol. Its IUPAC name is 2-pyrrolidin-3-yl-5-(trifluoromethyl)pyridine;hydrochloride.

Molecular Properties

Compound Name2-pyrrolidin-3-yl-5-(trifluoromethyl)pyridine;hydrochloride
PubChem CID171371651
Molecular FormulaC10H12ClF3N2
Molecular Weight252.67 g/mol
Exact Mass252.06
IUPAC Name2-pyrrolidin-3-yl-5-(trifluoromethyl)pyridine;hydrochloride
SMILESCl.FC(F)(F)c1ccc(C2CCNC2)nc1
InChIInChI=1S/C10H11F3N2.ClH/c11-10(12,13)8-1-2-9(15-6-8)7-3-4-14-5-7;/h1-2,6-7,14H,3-5H2;1H
InChIKeyAJMDEFDLMBZSIN-UHFFFAOYSA-N
XLogP2.60
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.67
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-pyrrolidin-3-yl-5-(trifluoromethyl)pyridine;hydrochloride with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-pyrrolidin-3-yl-5-(trifluoromethyl)pyridine;hydrochloride?
The IUPAC name of 2-pyrrolidin-3-yl-5-(trifluoromethyl)pyridine;hydrochloride (CID 171371651) is 2-pyrrolidin-3-yl-5-(trifluoromethyl)pyridine;hydrochloride.
What is the SMILES notation for 2-pyrrolidin-3-yl-5-(trifluoromethyl)pyridine;hydrochloride?
The canonical SMILES for 2-pyrrolidin-3-yl-5-(trifluoromethyl)pyridine;hydrochloride is Cl.FC(F)(F)c1ccc(C2CCNC2)nc1.
What is the InChIKey of 2-pyrrolidin-3-yl-5-(trifluoromethyl)pyridine;hydrochloride?
The InChIKey is AJMDEFDLMBZSIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F3N2.ClH/c11-10(12,13)8-1-2-9(15-6-8)7-3-4-14-5-7;/h1-2,6-7,14H,3-5H2;1H.
What are the key properties of 2-pyrrolidin-3-yl-5-(trifluoromethyl)pyridine;hydrochloride?
2-pyrrolidin-3-yl-5-(trifluoromethyl)pyridine;hydrochloride has a molecular weight of 252.67 g/mol, XLogP of 2.60, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyrrolidin-3-yl-5-(trifluoromethyl)pyridine;hydrochloride is sourced from PubChem (CID 171371651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).