1,4-dimethyl-2-(2-phenylethyl)-3,6-dihydro-2H-pyridine

C15H21N — CID 58123984

IUPAC1,4-dimethyl-2-(2-phenylethyl)-3,6-dihydro-2H-pyridine
SMILESCC1=CCN(C)C(CCc2ccccc2)C1
InChIInChI=1S/C15H21N/c1-13-10-11-16(2)15(12-13)9-8-14-6-4-3-5-7-14/h3-7,10,15H,8-9,11-12H2,1-2H3
InChIKeyFZDDJYGGPUCDLX-UHFFFAOYSA-N
MW215.34 g/mol
LogP3.27
Rot. Bonds3

About 1,4-dimethyl-2-(2-phenylethyl)-3,6-dihydro-2H-pyridine

1,4-dimethyl-2-(2-phenylethyl)-3,6-dihydro-2H-pyridine (PubChem CID 58123984) has the molecular formula C15H21N and a molecular weight of 215.34 g/mol. Its IUPAC name is 1,4-dimethyl-2-(2-phenylethyl)-3,6-dihydro-2H-pyridine.

Molecular Properties

Compound Name1,4-dimethyl-2-(2-phenylethyl)-3,6-dihydro-2H-pyridine
PubChem CID58123984
Molecular FormulaC15H21N
Molecular Weight215.34 g/mol
Exact Mass215.17
IUPAC Name1,4-dimethyl-2-(2-phenylethyl)-3,6-dihydro-2H-pyridine
SMILESCC1=CCN(C)C(CCc2ccccc2)C1
InChIInChI=1S/C15H21N/c1-13-10-11-16(2)15(12-13)9-8-14-6-4-3-5-7-14/h3-7,10,15H,8-9,11-12H2,1-2H3
InChIKeyFZDDJYGGPUCDLX-UHFFFAOYSA-N
XLogP3.27
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 53.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 1,4-dimethyl-2-(2-phenylethyl)-3,6-dihydro-2H-pyridine 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 1,4-dimethyl-2-(2-phenylethyl)-3,6-dihydro-2H-pyridine?
The IUPAC name of 1,4-dimethyl-2-(2-phenylethyl)-3,6-dihydro-2H-pyridine (CID 58123984) is 1,4-dimethyl-2-(2-phenylethyl)-3,6-dihydro-2H-pyridine.
What is the SMILES notation for 1,4-dimethyl-2-(2-phenylethyl)-3,6-dihydro-2H-pyridine?
The canonical SMILES for 1,4-dimethyl-2-(2-phenylethyl)-3,6-dihydro-2H-pyridine is CC1=CCN(C)C(CCc2ccccc2)C1.
What is the InChIKey of 1,4-dimethyl-2-(2-phenylethyl)-3,6-dihydro-2H-pyridine?
The InChIKey is FZDDJYGGPUCDLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N/c1-13-10-11-16(2)15(12-13)9-8-14-6-4-3-5-7-14/h3-7,10,15H,8-9,11-12H2,1-2H3.
What are the key properties of 1,4-dimethyl-2-(2-phenylethyl)-3,6-dihydro-2H-pyridine?
1,4-dimethyl-2-(2-phenylethyl)-3,6-dihydro-2H-pyridine has a molecular weight of 215.34 g/mol, XLogP of 3.27, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dimethyl-2-(2-phenylethyl)-3,6-dihydro-2H-pyridine is sourced from PubChem (CID 58123984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).