6-(2-methoxyethoxy)-2-methyl-2,3-dihydropyridine

C9H15NO2 — CID 67991663

IUPAC6-(2-methoxyethoxy)-2-methyl-2,3-dihydropyridine
SMILESCOCCOC1=NC(C)CC=C1
InChIInChI=1S/C9H15NO2/c1-8-4-3-5-9(10-8)12-7-6-11-2/h3,5,8H,4,6-7H2,1-2H3
InChIKeyYVNGDXQTJZQEJE-UHFFFAOYSA-N
MW169.22 g/mol
LogP1.40
Rot. Bonds3

About 6-(2-methoxyethoxy)-2-methyl-2,3-dihydropyridine

6-(2-methoxyethoxy)-2-methyl-2,3-dihydropyridine (PubChem CID 67991663) has the molecular formula C9H15NO2 and a molecular weight of 169.22 g/mol. Its IUPAC name is 6-(2-methoxyethoxy)-2-methyl-2,3-dihydropyridine.

Molecular Properties

Compound Name6-(2-methoxyethoxy)-2-methyl-2,3-dihydropyridine
PubChem CID67991663
Molecular FormulaC9H15NO2
Molecular Weight169.22 g/mol
Exact Mass169.11
IUPAC Name6-(2-methoxyethoxy)-2-methyl-2,3-dihydropyridine
SMILESCOCCOC1=NC(C)CC=C1
InChIInChI=1S/C9H15NO2/c1-8-4-3-5-9(10-8)12-7-6-11-2/h3,5,8H,4,6-7H2,1-2H3
InChIKeyYVNGDXQTJZQEJE-UHFFFAOYSA-N
XLogP1.40
TPSA30.82 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.22
LogP ≤ 51.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 6-(2-methoxyethoxy)-2-methyl-2,3-dihydropyridine?
The IUPAC name of 6-(2-methoxyethoxy)-2-methyl-2,3-dihydropyridine (CID 67991663) is 6-(2-methoxyethoxy)-2-methyl-2,3-dihydropyridine.
What is the SMILES notation for 6-(2-methoxyethoxy)-2-methyl-2,3-dihydropyridine?
The canonical SMILES for 6-(2-methoxyethoxy)-2-methyl-2,3-dihydropyridine is COCCOC1=NC(C)CC=C1.
What is the InChIKey of 6-(2-methoxyethoxy)-2-methyl-2,3-dihydropyridine?
The InChIKey is YVNGDXQTJZQEJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO2/c1-8-4-3-5-9(10-8)12-7-6-11-2/h3,5,8H,4,6-7H2,1-2H3.
What are the key properties of 6-(2-methoxyethoxy)-2-methyl-2,3-dihydropyridine?
6-(2-methoxyethoxy)-2-methyl-2,3-dihydropyridine has a molecular weight of 169.22 g/mol, XLogP of 1.40, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-methoxyethoxy)-2-methyl-2,3-dihydropyridine is sourced from PubChem (CID 67991663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).