2,6-dimethyl-5-(2-methylpropyl)-3,4-dihydropyridine

C11H19N — CID 167187205

IUPAC2,6-dimethyl-5-(2-methylpropyl)-3,4-dihydropyridine
SMILESCC1=NC(C)=C(CC(C)C)CC1
InChIInChI=1S/C11H19N/c1-8(2)7-11-6-5-9(3)12-10(11)4/h8H,5-7H2,1-4H3
InChIKeyARYUUVKZFOEBBD-UHFFFAOYSA-N
MW165.28 g/mol
LogP3.56
Rot. Bonds2

About 2,6-dimethyl-5-(2-methylpropyl)-3,4-dihydropyridine

2,6-dimethyl-5-(2-methylpropyl)-3,4-dihydropyridine (PubChem CID 167187205) has the molecular formula C11H19N and a molecular weight of 165.28 g/mol. Its IUPAC name is 2,6-dimethyl-5-(2-methylpropyl)-3,4-dihydropyridine.

Molecular Properties

Compound Name2,6-dimethyl-5-(2-methylpropyl)-3,4-dihydropyridine
PubChem CID167187205
Molecular FormulaC11H19N
Molecular Weight165.28 g/mol
Exact Mass165.15
IUPAC Name2,6-dimethyl-5-(2-methylpropyl)-3,4-dihydropyridine
SMILESCC1=NC(C)=C(CC(C)C)CC1
InChIInChI=1S/C11H19N/c1-8(2)7-11-6-5-9(3)12-10(11)4/h8H,5-7H2,1-4H3
InChIKeyARYUUVKZFOEBBD-UHFFFAOYSA-N
XLogP3.56
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.28
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 2,6-dimethyl-5-(2-methylpropyl)-3,4-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 2,6-dimethyl-5-(2-methylpropyl)-3,4-dihydropyridine?
The IUPAC name of 2,6-dimethyl-5-(2-methylpropyl)-3,4-dihydropyridine (CID 167187205) is 2,6-dimethyl-5-(2-methylpropyl)-3,4-dihydropyridine.
What is the SMILES notation for 2,6-dimethyl-5-(2-methylpropyl)-3,4-dihydropyridine?
The canonical SMILES for 2,6-dimethyl-5-(2-methylpropyl)-3,4-dihydropyridine is CC1=NC(C)=C(CC(C)C)CC1.
What is the InChIKey of 2,6-dimethyl-5-(2-methylpropyl)-3,4-dihydropyridine?
The InChIKey is ARYUUVKZFOEBBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N/c1-8(2)7-11-6-5-9(3)12-10(11)4/h8H,5-7H2,1-4H3.
What are the key properties of 2,6-dimethyl-5-(2-methylpropyl)-3,4-dihydropyridine?
2,6-dimethyl-5-(2-methylpropyl)-3,4-dihydropyridine has a molecular weight of 165.28 g/mol, XLogP of 3.56, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-5-(2-methylpropyl)-3,4-dihydropyridine is sourced from PubChem (CID 167187205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).