2-ethoxy-8-methoxy-4-methylquinoline

C13H15NO2 — CID 70328444

IUPAC2-ethoxy-8-methoxy-4-methylquinoline
SMILESCCOc1cc(C)c2cccc(OC)c2n1
InChIInChI=1S/C13H15NO2/c1-4-16-12-8-9(2)10-6-5-7-11(15-3)13(10)14-12/h5-8H,4H2,1-3H3
InChIKeySPTFKPYDRKUJHN-UHFFFAOYSA-N
MW217.27 g/mol
LogP2.95
Rot. Bonds3

About 2-ethoxy-8-methoxy-4-methylquinoline

2-ethoxy-8-methoxy-4-methylquinoline (PubChem CID 70328444) has the molecular formula C13H15NO2 and a molecular weight of 217.27 g/mol. Its IUPAC name is 2-ethoxy-8-methoxy-4-methylquinoline.

Molecular Properties

Compound Name2-ethoxy-8-methoxy-4-methylquinoline
PubChem CID70328444
Molecular FormulaC13H15NO2
Molecular Weight217.27 g/mol
Exact Mass217.11
IUPAC Name2-ethoxy-8-methoxy-4-methylquinoline
SMILESCCOc1cc(C)c2cccc(OC)c2n1
InChIInChI=1S/C13H15NO2/c1-4-16-12-8-9(2)10-6-5-7-11(15-3)13(10)14-12/h5-8H,4H2,1-3H3
InChIKeySPTFKPYDRKUJHN-UHFFFAOYSA-N
XLogP2.95
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 52.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-8-methoxy-4-methylquinoline?
The IUPAC name of 2-ethoxy-8-methoxy-4-methylquinoline (CID 70328444) is 2-ethoxy-8-methoxy-4-methylquinoline.
What is the SMILES notation for 2-ethoxy-8-methoxy-4-methylquinoline?
The canonical SMILES for 2-ethoxy-8-methoxy-4-methylquinoline is CCOc1cc(C)c2cccc(OC)c2n1.
What is the InChIKey of 2-ethoxy-8-methoxy-4-methylquinoline?
The InChIKey is SPTFKPYDRKUJHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO2/c1-4-16-12-8-9(2)10-6-5-7-11(15-3)13(10)14-12/h5-8H,4H2,1-3H3.
What are the key properties of 2-ethoxy-8-methoxy-4-methylquinoline?
2-ethoxy-8-methoxy-4-methylquinoline has a molecular weight of 217.27 g/mol, XLogP of 2.95, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-8-methoxy-4-methylquinoline is sourced from PubChem (CID 70328444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).