2-ethyl-6-(2-methoxyethoxy)-4-methyl-2,3-dihydropyridine

C11H19NO2 — CID 130223223

IUPAC2-ethyl-6-(2-methoxyethoxy)-4-methyl-2,3-dihydropyridine
SMILESCCC1CC(C)=CC(OCCOC)=N1
InChIInChI=1S/C11H19NO2/c1-4-10-7-9(2)8-11(12-10)14-6-5-13-3/h8,10H,4-7H2,1-3H3
InChIKeyDKLHFRNLPOXSNS-UHFFFAOYSA-N
MW197.28 g/mol
LogP2.18
Rot. Bonds4

About 2-ethyl-6-(2-methoxyethoxy)-4-methyl-2,3-dihydropyridine

2-ethyl-6-(2-methoxyethoxy)-4-methyl-2,3-dihydropyridine (PubChem CID 130223223) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is 2-ethyl-6-(2-methoxyethoxy)-4-methyl-2,3-dihydropyridine.

Molecular Properties

Compound Name2-ethyl-6-(2-methoxyethoxy)-4-methyl-2,3-dihydropyridine
PubChem CID130223223
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC Name2-ethyl-6-(2-methoxyethoxy)-4-methyl-2,3-dihydropyridine
SMILESCCC1CC(C)=CC(OCCOC)=N1
InChIInChI=1S/C11H19NO2/c1-4-10-7-9(2)8-11(12-10)14-6-5-13-3/h8,10H,4-7H2,1-3H3
InChIKeyDKLHFRNLPOXSNS-UHFFFAOYSA-N
XLogP2.18
TPSA30.82 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 52.18
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 2-ethyl-6-(2-methoxyethoxy)-4-methyl-2,3-dihydropyridine?
The IUPAC name of 2-ethyl-6-(2-methoxyethoxy)-4-methyl-2,3-dihydropyridine (CID 130223223) is 2-ethyl-6-(2-methoxyethoxy)-4-methyl-2,3-dihydropyridine.
What is the SMILES notation for 2-ethyl-6-(2-methoxyethoxy)-4-methyl-2,3-dihydropyridine?
The canonical SMILES for 2-ethyl-6-(2-methoxyethoxy)-4-methyl-2,3-dihydropyridine is CCC1CC(C)=CC(OCCOC)=N1.
What is the InChIKey of 2-ethyl-6-(2-methoxyethoxy)-4-methyl-2,3-dihydropyridine?
The InChIKey is DKLHFRNLPOXSNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2/c1-4-10-7-9(2)8-11(12-10)14-6-5-13-3/h8,10H,4-7H2,1-3H3.
What are the key properties of 2-ethyl-6-(2-methoxyethoxy)-4-methyl-2,3-dihydropyridine?
2-ethyl-6-(2-methoxyethoxy)-4-methyl-2,3-dihydropyridine has a molecular weight of 197.28 g/mol, XLogP of 2.18, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-6-(2-methoxyethoxy)-4-methyl-2,3-dihydropyridine is sourced from PubChem (CID 130223223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).