3-[2-(3-phenylpiperidin-1-yl)ethyl]pyridine

C18H22N2 — CID 56852589

IUPAC3-[2-(3-phenylpiperidin-1-yl)ethyl]pyridine
SMILESc1ccc(C2CCCN(CCc3cccnc3)C2)cc1
InChIInChI=1S/C18H22N2/c1-2-7-17(8-3-1)18-9-5-12-20(15-18)13-10-16-6-4-11-19-14-16/h1-4,6-8,11,14,18H,5,9-10,12-13,15H2
InChIKeySWUIYLDRDPOART-UHFFFAOYSA-N
MW266.39 g/mol
LogP3.50
Rot. Bonds4

About 3-[2-(3-phenylpiperidin-1-yl)ethyl]pyridine

3-[2-(3-phenylpiperidin-1-yl)ethyl]pyridine (PubChem CID 56852589) has the molecular formula C18H22N2 and a molecular weight of 266.39 g/mol. Its IUPAC name is 3-[2-(3-phenylpiperidin-1-yl)ethyl]pyridine.

Molecular Properties

Compound Name3-[2-(3-phenylpiperidin-1-yl)ethyl]pyridine
PubChem CID56852589
Molecular FormulaC18H22N2
Molecular Weight266.39 g/mol
Exact Mass266.18
IUPAC Name3-[2-(3-phenylpiperidin-1-yl)ethyl]pyridine
SMILESc1ccc(C2CCCN(CCc3cccnc3)C2)cc1
InChIInChI=1S/C18H22N2/c1-2-7-17(8-3-1)18-9-5-12-20(15-18)13-10-16-6-4-11-19-14-16/h1-4,6-8,11,14,18H,5,9-10,12-13,15H2
InChIKeySWUIYLDRDPOART-UHFFFAOYSA-N
XLogP3.50
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 53.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3-[2-(3-phenylpiperidin-1-yl)ethyl]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

1-(2-pyridin-3-ylethyl)piperidin-3-ol
CID 63262678
[1-(2-pyridin-3-ylethyl)piperidin-3-yl]methanol
CID 63262723
3-(2-pyrrolidin-1-ylethyl)pyridine
CID 23273673
2-(3-phenylpyrrolidin-1-yl)-N-(pyridin-3-ylmethyl)ethanamine
CID 62559365
N-methyl-1-[1-(2-pyridin-3-ylethyl)piperidin-3-yl]methanamine;dihydrochloride
CID 119914710
3-phenyl-1-propylpiperidine
CID 12937946
3-[1-(2-phenylethyl)pyrrolidin-2-yl]pyridine
CID 91294184
2-[1-(2-pyridin-3-ylethyl)pyrrolidin-3-yl]ethanol
CID 115647965
N-[1-(2-pyridin-3-ylethyl)pyrrolidin-3-yl]pyrimidin-2-amine
CID 172881578
(2S)-4-(2-phenylethyl)-2-(pyridin-3-ylmethyl)morpholine
CID 124945226
4-(2-phenylethyl)-2-(pyridin-3-ylmethyl)morpholine
CID 102604196
3-(1-methylpiperidin-3-yl)pyridine
CID 118883076

Frequently Asked Questions

What is the IUPAC name of 3-[2-(3-phenylpiperidin-1-yl)ethyl]pyridine?
The IUPAC name of 3-[2-(3-phenylpiperidin-1-yl)ethyl]pyridine (CID 56852589) is 3-[2-(3-phenylpiperidin-1-yl)ethyl]pyridine.
What is the SMILES notation for 3-[2-(3-phenylpiperidin-1-yl)ethyl]pyridine?
The canonical SMILES for 3-[2-(3-phenylpiperidin-1-yl)ethyl]pyridine is c1ccc(C2CCCN(CCc3cccnc3)C2)cc1.
What is the InChIKey of 3-[2-(3-phenylpiperidin-1-yl)ethyl]pyridine?
The InChIKey is SWUIYLDRDPOART-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2/c1-2-7-17(8-3-1)18-9-5-12-20(15-18)13-10-16-6-4-11-19-14-16/h1-4,6-8,11,14,18H,5,9-10,12-13,15H2.
What are the key properties of 3-[2-(3-phenylpiperidin-1-yl)ethyl]pyridine?
3-[2-(3-phenylpiperidin-1-yl)ethyl]pyridine has a molecular weight of 266.39 g/mol, XLogP of 3.50, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(3-phenylpiperidin-1-yl)ethyl]pyridine is sourced from PubChem (CID 56852589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).