3-methyl-5-(2,3,4,5-tetrahydropyridin-6-yl)pyridine;dihydrochloride

C11H16Cl2N2 — CID 67024686

IUPAC3-methyl-5-(2,3,4,5-tetrahydropyridin-6-yl)pyridine;dihydrochloride
SMILESCc1cncc(C2=NCCCC2)c1.Cl.Cl
InChIInChI=1S/C11H14N2.2ClH/c1-9-6-10(8-12-7-9)11-4-2-3-5-13-11;;/h6-8H,2-5H2,1H3;2*1H
InChIKeyAYOILKXRBJHXBP-UHFFFAOYSA-N
MW247.17 g/mol
LogP3.21
Rot. Bonds1

About 3-methyl-5-(2,3,4,5-tetrahydropyridin-6-yl)pyridine;dihydrochloride

3-methyl-5-(2,3,4,5-tetrahydropyridin-6-yl)pyridine;dihydrochloride (PubChem CID 67024686) has the molecular formula C11H16Cl2N2 and a molecular weight of 247.17 g/mol. Its IUPAC name is 3-methyl-5-(2,3,4,5-tetrahydropyridin-6-yl)pyridine;dihydrochloride.

Molecular Properties

Compound Name3-methyl-5-(2,3,4,5-tetrahydropyridin-6-yl)pyridine;dihydrochloride
PubChem CID67024686
Molecular FormulaC11H16Cl2N2
Molecular Weight247.17 g/mol
Exact Mass246.07
IUPAC Name3-methyl-5-(2,3,4,5-tetrahydropyridin-6-yl)pyridine;dihydrochloride
SMILESCc1cncc(C2=NCCCC2)c1.Cl.Cl
InChIInChI=1S/C11H14N2.2ClH/c1-9-6-10(8-12-7-9)11-4-2-3-5-13-11;;/h6-8H,2-5H2,1H3;2*1H
InChIKeyAYOILKXRBJHXBP-UHFFFAOYSA-N
XLogP3.21
TPSA25.25 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.17
LogP ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3-methyl-5-(2,3,4,5-tetrahydropyridin-6-yl)pyridine;dihydrochloride 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-methyl-5-(2,3,4,5-tetrahydropyridin-6-yl)pyridine;dihydrochloride?
The IUPAC name of 3-methyl-5-(2,3,4,5-tetrahydropyridin-6-yl)pyridine;dihydrochloride (CID 67024686) is 3-methyl-5-(2,3,4,5-tetrahydropyridin-6-yl)pyridine;dihydrochloride.
What is the SMILES notation for 3-methyl-5-(2,3,4,5-tetrahydropyridin-6-yl)pyridine;dihydrochloride?
The canonical SMILES for 3-methyl-5-(2,3,4,5-tetrahydropyridin-6-yl)pyridine;dihydrochloride is Cc1cncc(C2=NCCCC2)c1.Cl.Cl.
What is the InChIKey of 3-methyl-5-(2,3,4,5-tetrahydropyridin-6-yl)pyridine;dihydrochloride?
The InChIKey is AYOILKXRBJHXBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2.2ClH/c1-9-6-10(8-12-7-9)11-4-2-3-5-13-11;;/h6-8H,2-5H2,1H3;2*1H.
What are the key properties of 3-methyl-5-(2,3,4,5-tetrahydropyridin-6-yl)pyridine;dihydrochloride?
3-methyl-5-(2,3,4,5-tetrahydropyridin-6-yl)pyridine;dihydrochloride has a molecular weight of 247.17 g/mol, XLogP of 3.21, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5-(2,3,4,5-tetrahydropyridin-6-yl)pyridine;dihydrochloride is sourced from PubChem (CID 67024686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).