3-[2-(diethylamino)ethoxy]-10H-acridin-9-one

C19H22N2O2 — CID 24991441

IUPAC3-[2-(diethylamino)ethoxy]-10H-acridin-9-one
SMILESCCN(CC)CCOc1ccc2c(=O)c3ccccc3[nH]c2c1
InChIInChI=1S/C19H22N2O2/c1-3-21(4-2)11-12-23-14-9-10-16-18(13-14)20-17-8-6-5-7-15(17)19(16)22/h5-10,13H,3-4,11-12H2,1-2H3,(H,20,22)
InChIKeyYUXBUABQCQGRKI-UHFFFAOYSA-N
MW310.40 g/mol
LogP3.40
Rot. Bonds6

About 3-[2-(diethylamino)ethoxy]-10H-acridin-9-one

3-[2-(diethylamino)ethoxy]-10H-acridin-9-one (PubChem CID 24991441) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is 3-[2-(diethylamino)ethoxy]-10H-acridin-9-one.

Molecular Properties

Compound Name3-[2-(diethylamino)ethoxy]-10H-acridin-9-one
PubChem CID24991441
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC Name3-[2-(diethylamino)ethoxy]-10H-acridin-9-one
SMILESCCN(CC)CCOc1ccc2c(=O)c3ccccc3[nH]c2c1
InChIInChI=1S/C19H22N2O2/c1-3-21(4-2)11-12-23-14-9-10-16-18(13-14)20-17-8-6-5-7-15(17)19(16)22/h5-10,13H,3-4,11-12H2,1-2H3,(H,20,22)
InChIKeyYUXBUABQCQGRKI-UHFFFAOYSA-N
XLogP3.40
TPSA45.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-chloro-6-[2-(diethylamino)ethoxy]-10H-acridin-9-one
CID 59242964
3,6-bis[2-(diethylamino)ethoxy]-10-[2-(diethylamino)ethyl]acridin-9-one;3-chloro-6-[2-(diethylamino)ethoxy]-10-[2-(diethylamino)ethyl]acridin-9-one;3-chloro-10-[2-(diethylamino)ethyl]-6-[3-(diethylamino)propoxy]acridin-9-one;3-[2-(diethylamino)ethoxy]-10H-acridin-9-one;3-[2-(diethylamino)ethoxy]-10-[2-(diethylamino)ethyl]-6-methylacridin-9-one
CID 159800506
3,6-bis[3-(dipropylamino)propoxy]-10H-acridin-9-one
CID 57439687
2,7-bis[2-(dipropylamino)ethoxy]-10H-acridin-9-one
CID 57439654
1,3-dichloro-6-[3-(diethylamino)propoxy]-10H-acridin-9-one
CID 155560204
2-octoxy-10H-acridin-9-one
CID 611041
6-[3-(diethylamino)propoxy]-1,3-difluoro-10H-acridin-9-one
CID 155524049
3-chloro-5-[2-(diethylamino)ethoxy]-10H-acridin-9-one
CID 129138233
3-[2-(diethylamino)ethoxy]-6-ethoxyxanthen-9-one
CID 154225288
2,7-bis[2-(dimethylamino)ethoxy]-10H-acridin-9-one
CID 57439652
5,12-dihydroquinolino[2,3-b]acridine-7,14-dione;ethane
CID 90939428
3-[4-(diethylamino)butoxy]xanthen-9-one
CID 25199046

Frequently Asked Questions

What is the IUPAC name of 3-[2-(diethylamino)ethoxy]-10H-acridin-9-one?
The IUPAC name of 3-[2-(diethylamino)ethoxy]-10H-acridin-9-one (CID 24991441) is 3-[2-(diethylamino)ethoxy]-10H-acridin-9-one.
What is the SMILES notation for 3-[2-(diethylamino)ethoxy]-10H-acridin-9-one?
The canonical SMILES for 3-[2-(diethylamino)ethoxy]-10H-acridin-9-one is CCN(CC)CCOc1ccc2c(=O)c3ccccc3[nH]c2c1.
What is the InChIKey of 3-[2-(diethylamino)ethoxy]-10H-acridin-9-one?
The InChIKey is YUXBUABQCQGRKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2/c1-3-21(4-2)11-12-23-14-9-10-16-18(13-14)20-17-8-6-5-7-15(17)19(16)22/h5-10,13H,3-4,11-12H2,1-2H3,(H,20,22).
What are the key properties of 3-[2-(diethylamino)ethoxy]-10H-acridin-9-one?
3-[2-(diethylamino)ethoxy]-10H-acridin-9-one has a molecular weight of 310.40 g/mol, XLogP of 3.40, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(diethylamino)ethoxy]-10H-acridin-9-one is sourced from PubChem (CID 24991441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).