2-[6-[2-(dimethylamino)ethoxy]acridin-3-yl]oxy-N,N-dimethylethanamine

C21H27N3O2 — CID 20553504

IUPAC2-[6-[2-(dimethylamino)ethoxy]acridin-3-yl]oxy-N,N-dimethylethanamine
SMILESCN(C)CCOc1ccc2cc3ccc(OCCN(C)C)cc3nc2c1
InChIInChI=1S/C21H27N3O2/c1-23(2)9-11-25-18-7-5-16-13-17-6-8-19(26-12-10-24(3)4)15-21(17)22-20(16)14-18/h5-8,13-15H,9-12H2,1-4H3
InChIKeyIJEGQPCVVCTYCG-UHFFFAOYSA-N
MW353.47 g/mol
LogP3.27
Rot. Bonds8

About 2-[6-[2-(dimethylamino)ethoxy]acridin-3-yl]oxy-N,N-dimethylethanamine

2-[6-[2-(dimethylamino)ethoxy]acridin-3-yl]oxy-N,N-dimethylethanamine (PubChem CID 20553504) has the molecular formula C21H27N3O2 and a molecular weight of 353.47 g/mol. Its IUPAC name is 2-[6-[2-(dimethylamino)ethoxy]acridin-3-yl]oxy-N,N-dimethylethanamine.

Molecular Properties

Compound Name2-[6-[2-(dimethylamino)ethoxy]acridin-3-yl]oxy-N,N-dimethylethanamine
PubChem CID20553504
Molecular FormulaC21H27N3O2
Molecular Weight353.47 g/mol
Exact Mass353.21
IUPAC Name2-[6-[2-(dimethylamino)ethoxy]acridin-3-yl]oxy-N,N-dimethylethanamine
SMILESCN(C)CCOc1ccc2cc3ccc(OCCN(C)C)cc3nc2c1
InChIInChI=1S/C21H27N3O2/c1-23(2)9-11-25-18-7-5-16-13-17-6-8-19(26-12-10-24(3)4)15-21(17)22-20(16)14-18/h5-8,13-15H,9-12H2,1-4H3
InChIKeyIJEGQPCVVCTYCG-UHFFFAOYSA-N
XLogP3.27
TPSA37.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.47
LogP ≤ 53.27
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

2-[6-[2-(diethylamino)ethoxy]acridin-3-yl]oxy-N,N-diethylethanamine;platinum(4+);tetrachloride
CID 173439217
2-[6-[2-(diethylamino)ethoxy]acridin-3-yl]oxy-N,N-diethylethanamine;zinc;hydrochloride
CID 88751722
N-butyl-N-[3-[6-[3-(dibutylamino)propoxy]acridin-3-yl]oxypropyl]butan-1-amine
CID 88785633
N-methyl-2-[6-[2-(methylamino)ethoxy]acridin-3-yl]oxyethanamine;trihydrochloride
CID 20553444
2-[6-(2-aminoethoxy)acridin-3-yl]oxyethanamine;hydrochloride
CID 88770124
2-(3,4-dichlorophenoxy)-N,N-dimethylethanamine
CID 86117410
2-[6-(2-aminoethoxy)acridin-3-yl]oxyethanamine;hydrate;hydrochloride
CID 45260071
N-methyl-3-[6-[3-(methylamino)propoxy]acridin-3-yl]oxypropan-1-amine;hydrate;hydrochloride
CID 45260080
3-hexoxyacridine
CID 141299786
2-(3,4-dimethylphenoxy)-N,N-dimethylethanamine
CID 82075858
1-[6-[2-(dimethylamino)propoxy]acridin-3-yl]oxy-N,N-dimethylpropan-2-amine;iron
CID 88751664
N-[4-[2-(dimethylamino)ethoxy]phenyl]-4-methoxy-N-methylaniline
CID 110455054

Frequently Asked Questions

What is the IUPAC name of 2-[6-[2-(dimethylamino)ethoxy]acridin-3-yl]oxy-N,N-dimethylethanamine?
The IUPAC name of 2-[6-[2-(dimethylamino)ethoxy]acridin-3-yl]oxy-N,N-dimethylethanamine (CID 20553504) is 2-[6-[2-(dimethylamino)ethoxy]acridin-3-yl]oxy-N,N-dimethylethanamine.
What is the SMILES notation for 2-[6-[2-(dimethylamino)ethoxy]acridin-3-yl]oxy-N,N-dimethylethanamine?
The canonical SMILES for 2-[6-[2-(dimethylamino)ethoxy]acridin-3-yl]oxy-N,N-dimethylethanamine is CN(C)CCOc1ccc2cc3ccc(OCCN(C)C)cc3nc2c1.
What is the InChIKey of 2-[6-[2-(dimethylamino)ethoxy]acridin-3-yl]oxy-N,N-dimethylethanamine?
The InChIKey is IJEGQPCVVCTYCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H27N3O2/c1-23(2)9-11-25-18-7-5-16-13-17-6-8-19(26-12-10-24(3)4)15-21(17)22-20(16)14-18/h5-8,13-15H,9-12H2,1-4H3.
What are the key properties of 2-[6-[2-(dimethylamino)ethoxy]acridin-3-yl]oxy-N,N-dimethylethanamine?
2-[6-[2-(dimethylamino)ethoxy]acridin-3-yl]oxy-N,N-dimethylethanamine has a molecular weight of 353.47 g/mol, XLogP of 3.27, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-[2-(dimethylamino)ethoxy]acridin-3-yl]oxy-N,N-dimethylethanamine is sourced from PubChem (CID 20553504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).