3-[3-(4-ethylpiperidin-1-yl)propyl]-5-methylpyridine

C16H26N2 — CID 143913543

IUPAC3-[3-(4-ethylpiperidin-1-yl)propyl]-5-methylpyridine
SMILESCCC1CCN(CCCc2cncc(C)c2)CC1
InChIInChI=1S/C16H26N2/c1-3-15-6-9-18(10-7-15)8-4-5-16-11-14(2)12-17-13-16/h11-13,15H,3-10H2,1-2H3
InChIKeyWFXYABDHXIQQQK-UHFFFAOYSA-N
MW246.40 g/mol
LogP3.44
Rot. Bonds5

About 3-[3-(4-ethylpiperidin-1-yl)propyl]-5-methylpyridine

3-[3-(4-ethylpiperidin-1-yl)propyl]-5-methylpyridine (PubChem CID 143913543) has the molecular formula C16H26N2 and a molecular weight of 246.40 g/mol. Its IUPAC name is 3-[3-(4-ethylpiperidin-1-yl)propyl]-5-methylpyridine.

Molecular Properties

Compound Name3-[3-(4-ethylpiperidin-1-yl)propyl]-5-methylpyridine
PubChem CID143913543
Molecular FormulaC16H26N2
Molecular Weight246.40 g/mol
Exact Mass246.21
IUPAC Name3-[3-(4-ethylpiperidin-1-yl)propyl]-5-methylpyridine
SMILESCCC1CCN(CCCc2cncc(C)c2)CC1
InChIInChI=1S/C16H26N2/c1-3-15-6-9-18(10-7-15)8-4-5-16-11-14(2)12-17-13-16/h11-13,15H,3-10H2,1-2H3
InChIKeyWFXYABDHXIQQQK-UHFFFAOYSA-N
XLogP3.44
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.40
LogP ≤ 53.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3-[3-(4-ethylpiperidin-1-yl)propyl]-5-methylpyridine 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 3-[3-(4-ethylpiperidin-1-yl)propyl]-5-methylpyridine?
The IUPAC name of 3-[3-(4-ethylpiperidin-1-yl)propyl]-5-methylpyridine (CID 143913543) is 3-[3-(4-ethylpiperidin-1-yl)propyl]-5-methylpyridine.
What is the SMILES notation for 3-[3-(4-ethylpiperidin-1-yl)propyl]-5-methylpyridine?
The canonical SMILES for 3-[3-(4-ethylpiperidin-1-yl)propyl]-5-methylpyridine is CCC1CCN(CCCc2cncc(C)c2)CC1.
What is the InChIKey of 3-[3-(4-ethylpiperidin-1-yl)propyl]-5-methylpyridine?
The InChIKey is WFXYABDHXIQQQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2/c1-3-15-6-9-18(10-7-15)8-4-5-16-11-14(2)12-17-13-16/h11-13,15H,3-10H2,1-2H3.
What are the key properties of 3-[3-(4-ethylpiperidin-1-yl)propyl]-5-methylpyridine?
3-[3-(4-ethylpiperidin-1-yl)propyl]-5-methylpyridine has a molecular weight of 246.40 g/mol, XLogP of 3.44, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(4-ethylpiperidin-1-yl)propyl]-5-methylpyridine is sourced from PubChem (CID 143913543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).