6,7,8,9-tetramethoxy-4H-quinolizine

C13H17NO4 — CID 90908290

IUPAC6,7,8,9-tetramethoxy-4H-quinolizine
SMILESCOC1=C(OC)C(OC)=C(OC)N2CC=CC=C12
InChIInChI=1S/C13H17NO4/c1-15-10-9-7-5-6-8-14(9)13(18-4)12(17-3)11(10)16-2/h5-7H,8H2,1-4H3
InChIKeyAUAUQFZTRVGOQL-UHFFFAOYSA-N
MW251.28 g/mol
LogP1.72
Rot. Bonds4

About 6,7,8,9-tetramethoxy-4H-quinolizine

6,7,8,9-tetramethoxy-4H-quinolizine (PubChem CID 90908290) has the molecular formula C13H17NO4 and a molecular weight of 251.28 g/mol. Its IUPAC name is 6,7,8,9-tetramethoxy-4H-quinolizine.

Molecular Properties

Compound Name6,7,8,9-tetramethoxy-4H-quinolizine
PubChem CID90908290
Molecular FormulaC13H17NO4
Molecular Weight251.28 g/mol
Exact Mass251.12
IUPAC Name6,7,8,9-tetramethoxy-4H-quinolizine
SMILESCOC1=C(OC)C(OC)=C(OC)N2CC=CC=C12
InChIInChI=1S/C13H17NO4/c1-15-10-9-7-5-6-8-14(9)13(18-4)12(17-3)11(10)16-2/h5-7H,8H2,1-4H3
InChIKeyAUAUQFZTRVGOQL-UHFFFAOYSA-N
XLogP1.72
TPSA40.16 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.28
LogP ≤ 51.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6,7,8,9-tetramethoxy-4H-quinolizine?
The IUPAC name of 6,7,8,9-tetramethoxy-4H-quinolizine (CID 90908290) is 6,7,8,9-tetramethoxy-4H-quinolizine.
What is the SMILES notation for 6,7,8,9-tetramethoxy-4H-quinolizine?
The canonical SMILES for 6,7,8,9-tetramethoxy-4H-quinolizine is COC1=C(OC)C(OC)=C(OC)N2CC=CC=C12.
What is the InChIKey of 6,7,8,9-tetramethoxy-4H-quinolizine?
The InChIKey is AUAUQFZTRVGOQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO4/c1-15-10-9-7-5-6-8-14(9)13(18-4)12(17-3)11(10)16-2/h5-7H,8H2,1-4H3.
What are the key properties of 6,7,8,9-tetramethoxy-4H-quinolizine?
6,7,8,9-tetramethoxy-4H-quinolizine has a molecular weight of 251.28 g/mol, XLogP of 1.72, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7,8,9-tetramethoxy-4H-quinolizine is sourced from PubChem (CID 90908290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).