4-methyl-2-piperidin-3-yl-1,4-dihydropyridine

C11H18N2 — CID 70224610

IUPAC4-methyl-2-piperidin-3-yl-1,4-dihydropyridine
SMILESCC1C=CNC(C2CCCNC2)=C1
InChIInChI=1S/C11H18N2/c1-9-4-6-13-11(7-9)10-3-2-5-12-8-10/h4,6-7,9-10,12-13H,2-3,5,8H2,1H3
InChIKeyUOWPHQMXCWYLEP-UHFFFAOYSA-N
MW178.28 g/mol
LogP1.62
Rot. Bonds1

About 4-methyl-2-piperidin-3-yl-1,4-dihydropyridine

4-methyl-2-piperidin-3-yl-1,4-dihydropyridine (PubChem CID 70224610) has the molecular formula C11H18N2 and a molecular weight of 178.28 g/mol. Its IUPAC name is 4-methyl-2-piperidin-3-yl-1,4-dihydropyridine.

Molecular Properties

Compound Name4-methyl-2-piperidin-3-yl-1,4-dihydropyridine
PubChem CID70224610
Molecular FormulaC11H18N2
Molecular Weight178.28 g/mol
Exact Mass178.15
IUPAC Name4-methyl-2-piperidin-3-yl-1,4-dihydropyridine
SMILESCC1C=CNC(C2CCCNC2)=C1
InChIInChI=1S/C11H18N2/c1-9-4-6-13-11(7-9)10-3-2-5-12-8-10/h4,6-7,9-10,12-13H,2-3,5,8H2,1H3
InChIKeyUOWPHQMXCWYLEP-UHFFFAOYSA-N
XLogP1.62
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.28
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-methyl-2-piperidin-3-yl-1,4-dihydropyridine 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 4-methyl-2-piperidin-3-yl-1,4-dihydropyridine?
The IUPAC name of 4-methyl-2-piperidin-3-yl-1,4-dihydropyridine (CID 70224610) is 4-methyl-2-piperidin-3-yl-1,4-dihydropyridine.
What is the SMILES notation for 4-methyl-2-piperidin-3-yl-1,4-dihydropyridine?
The canonical SMILES for 4-methyl-2-piperidin-3-yl-1,4-dihydropyridine is CC1C=CNC(C2CCCNC2)=C1.
What is the InChIKey of 4-methyl-2-piperidin-3-yl-1,4-dihydropyridine?
The InChIKey is UOWPHQMXCWYLEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2/c1-9-4-6-13-11(7-9)10-3-2-5-12-8-10/h4,6-7,9-10,12-13H,2-3,5,8H2,1H3.
What are the key properties of 4-methyl-2-piperidin-3-yl-1,4-dihydropyridine?
4-methyl-2-piperidin-3-yl-1,4-dihydropyridine has a molecular weight of 178.28 g/mol, XLogP of 1.62, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-piperidin-3-yl-1,4-dihydropyridine is sourced from PubChem (CID 70224610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).