1,3,6,8-tetramethoxyacridine

C17H17NO4 — CID 175793272

IUPAC1,3,6,8-tetramethoxyacridine
SMILESCOc1cc(OC)c2cc3c(OC)cc(OC)cc3nc2c1
InChIInChI=1S/C17H17NO4/c1-19-10-5-14-12(16(7-10)21-3)9-13-15(18-14)6-11(20-2)8-17(13)22-4/h5-9H,1-4H3
InChIKeyRGWWIRKNSFTRNF-UHFFFAOYSA-N
MW299.33 g/mol
LogP3.42
Rot. Bonds4

About 1,3,6,8-tetramethoxyacridine

1,3,6,8-tetramethoxyacridine (PubChem CID 175793272) has the molecular formula C17H17NO4 and a molecular weight of 299.33 g/mol. Its IUPAC name is 1,3,6,8-tetramethoxyacridine.

Molecular Properties

Compound Name1,3,6,8-tetramethoxyacridine
PubChem CID175793272
Molecular FormulaC17H17NO4
Molecular Weight299.33 g/mol
Exact Mass299.12
IUPAC Name1,3,6,8-tetramethoxyacridine
SMILESCOc1cc(OC)c2cc3c(OC)cc(OC)cc3nc2c1
InChIInChI=1S/C17H17NO4/c1-19-10-5-14-12(16(7-10)21-3)9-13-15(18-14)6-11(20-2)8-17(13)22-4/h5-9H,1-4H3
InChIKeyRGWWIRKNSFTRNF-UHFFFAOYSA-N
XLogP3.42
TPSA49.81 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.33
LogP ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

5,7-dimethoxy-3-methylquinolin-2-amine
CID 63232255
5,7-dimethoxyquinolin-3-ol
CID 10081664
(3-ethyl-5,7-dimethoxyquinolin-2-yl)hydrazine
CID 63233121
2-(5,7-dimethoxyquinolin-2-yl)acetonitrile
CID 84625416
1,3,7-trimethoxynaphthalene
CID 102088907
6,8-dimethoxy-3-methylisoquinoline
CID 134913416
chloro-tris(2,4,6-trimethoxyphenyl)silane
CID 88962916
5,7-dimethoxy-3-pyridin-4-ylquinoline;dihydrochloride
CID 45073427
(2E,3Z)-2-ethylidene-5,7-dimethoxy-3-(2-nitroethylidene)quinoline
CID 158186269
tert-butyl-dimethyl-(2,4,6-trimethoxyphenoxy)silane
CID 102281484
1-fluoro-2,3,5-trimethoxybenzene
CID 151392889
2,3,6,7-tetramethoxy-9-methylacridine
CID 46187785

Frequently Asked Questions

What is the IUPAC name of 1,3,6,8-tetramethoxyacridine?
The IUPAC name of 1,3,6,8-tetramethoxyacridine (CID 175793272) is 1,3,6,8-tetramethoxyacridine.
What is the SMILES notation for 1,3,6,8-tetramethoxyacridine?
The canonical SMILES for 1,3,6,8-tetramethoxyacridine is COc1cc(OC)c2cc3c(OC)cc(OC)cc3nc2c1.
What is the InChIKey of 1,3,6,8-tetramethoxyacridine?
The InChIKey is RGWWIRKNSFTRNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NO4/c1-19-10-5-14-12(16(7-10)21-3)9-13-15(18-14)6-11(20-2)8-17(13)22-4/h5-9H,1-4H3.
What are the key properties of 1,3,6,8-tetramethoxyacridine?
1,3,6,8-tetramethoxyacridine has a molecular weight of 299.33 g/mol, XLogP of 3.42, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3,6,8-tetramethoxyacridine is sourced from PubChem (CID 175793272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).