6-[2-(dimethylamino)ethoxy]-2-methoxy-10-methylacridin-9-one

C19H22N2O3 — CID 21323242

IUPAC6-[2-(dimethylamino)ethoxy]-2-methoxy-10-methylacridin-9-one
SMILESCOc1ccc2c(c1)c(=O)c1ccc(OCCN(C)C)cc1n2C
InChIInChI=1S/C19H22N2O3/c1-20(2)9-10-24-14-5-7-15-18(12-14)21(3)17-8-6-13(23-4)11-16(17)19(15)22/h5-8,11-12H,9-10H2,1-4H3
InChIKeyRRJMTKMOKLUQKQ-UHFFFAOYSA-N
MW326.40 g/mol
LogP2.64
Rot. Bonds5

About 6-[2-(dimethylamino)ethoxy]-2-methoxy-10-methylacridin-9-one

6-[2-(dimethylamino)ethoxy]-2-methoxy-10-methylacridin-9-one (PubChem CID 21323242) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is 6-[2-(dimethylamino)ethoxy]-2-methoxy-10-methylacridin-9-one.

Molecular Properties

Compound Name6-[2-(dimethylamino)ethoxy]-2-methoxy-10-methylacridin-9-one
PubChem CID21323242
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC Name6-[2-(dimethylamino)ethoxy]-2-methoxy-10-methylacridin-9-one
SMILESCOc1ccc2c(c1)c(=O)c1ccc(OCCN(C)C)cc1n2C
InChIInChI=1S/C19H22N2O3/c1-20(2)9-10-24-14-5-7-15-18(12-14)21(3)17-8-6-13(23-4)11-16(17)19(15)22/h5-8,11-12H,9-10H2,1-4H3
InChIKeyRRJMTKMOKLUQKQ-UHFFFAOYSA-N
XLogP2.64
TPSA43.70 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 52.64
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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Frequently Asked Questions

What is the IUPAC name of 6-[2-(dimethylamino)ethoxy]-2-methoxy-10-methylacridin-9-one?
The IUPAC name of 6-[2-(dimethylamino)ethoxy]-2-methoxy-10-methylacridin-9-one (CID 21323242) is 6-[2-(dimethylamino)ethoxy]-2-methoxy-10-methylacridin-9-one.
What is the SMILES notation for 6-[2-(dimethylamino)ethoxy]-2-methoxy-10-methylacridin-9-one?
The canonical SMILES for 6-[2-(dimethylamino)ethoxy]-2-methoxy-10-methylacridin-9-one is COc1ccc2c(c1)c(=O)c1ccc(OCCN(C)C)cc1n2C.
What is the InChIKey of 6-[2-(dimethylamino)ethoxy]-2-methoxy-10-methylacridin-9-one?
The InChIKey is RRJMTKMOKLUQKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-20(2)9-10-24-14-5-7-15-18(12-14)21(3)17-8-6-13(23-4)11-16(17)19(15)22/h5-8,11-12H,9-10H2,1-4H3.
What are the key properties of 6-[2-(dimethylamino)ethoxy]-2-methoxy-10-methylacridin-9-one?
6-[2-(dimethylamino)ethoxy]-2-methoxy-10-methylacridin-9-one has a molecular weight of 326.40 g/mol, XLogP of 2.64, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(dimethylamino)ethoxy]-2-methoxy-10-methylacridin-9-one is sourced from PubChem (CID 21323242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).