6-chloro-2-ethoxyacridin-9-amine

C15H13ClN2O — CID 71700026

IUPAC6-chloro-2-ethoxyacridin-9-amine
SMILESCCOc1ccc2nc3cc(Cl)ccc3c(N)c2c1
InChIInChI=1S/C15H13ClN2O/c1-2-19-10-4-6-13-12(8-10)15(17)11-5-3-9(16)7-14(11)18-13/h3-8H,2H2,1H3,(H2,17,18)
InChIKeyQFNHSWUFPJOTIR-UHFFFAOYSA-N
MW272.74 g/mol
LogP4.02
Rot. Bonds2

About 6-chloro-2-ethoxyacridin-9-amine

6-chloro-2-ethoxyacridin-9-amine (PubChem CID 71700026) has the molecular formula C15H13ClN2O and a molecular weight of 272.74 g/mol. Its IUPAC name is 6-chloro-2-ethoxyacridin-9-amine.

Molecular Properties

Compound Name6-chloro-2-ethoxyacridin-9-amine
PubChem CID71700026
Molecular FormulaC15H13ClN2O
Molecular Weight272.74 g/mol
Exact Mass272.07
IUPAC Name6-chloro-2-ethoxyacridin-9-amine
SMILESCCOc1ccc2nc3cc(Cl)ccc3c(N)c2c1
InChIInChI=1S/C15H13ClN2O/c1-2-19-10-4-6-13-12(8-10)15(17)11-5-3-9(16)7-14(11)18-13/h3-8H,2H2,1H3,(H2,17,18)
InChIKeyQFNHSWUFPJOTIR-UHFFFAOYSA-N
XLogP4.02
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.74
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'amino_acridine_A(46)', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

N-(9-amino-7-ethoxyacridin-3-yl)-4-cyanobenzamide
CID 132503348
6-ethoxy-3-methyl-2-(trifluoromethyl)quinolin-4-amine
CID 63743905
2-chloro-7-ethoxy-5-oxidophenazin-5-ium
CID 102009314
7-ethoxy-9-N-propylacridine-3,9-diamine
CID 10685301
N,N'-bis(6-chloro-2-methoxyacridin-9-yl)nonane-1,9-diamine
CID 158996243
N'-(6-chloro-2-methoxyacridin-9-yl)heptane-1,7-diamine
CID 511167
6-chloro-2-methoxy-N-octylacridin-9-amine
CID 44537218
7-ethoxy-3-N,3-N,9-N,9-N-tetrahydroxyacridine-3,9-diamine
CID 170245037
7-ethoxy-3-N,3-N,9-N,9-N-tetramethylacridine-3,9-diamine
CID 169281625
6-chloro-2-methoxy-N,N-dimethylacridin-9-amine
CID 71406674
N-butyl-6-chloro-2-methoxyacridin-9-amine;ethane
CID 166169543
4-N-(6-chloro-2-methoxyacridin-9-yl)benzene-1,4-diamine
CID 56666124

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-ethoxyacridin-9-amine?
The IUPAC name of 6-chloro-2-ethoxyacridin-9-amine (CID 71700026) is 6-chloro-2-ethoxyacridin-9-amine.
What is the SMILES notation for 6-chloro-2-ethoxyacridin-9-amine?
The canonical SMILES for 6-chloro-2-ethoxyacridin-9-amine is CCOc1ccc2nc3cc(Cl)ccc3c(N)c2c1.
What is the InChIKey of 6-chloro-2-ethoxyacridin-9-amine?
The InChIKey is QFNHSWUFPJOTIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClN2O/c1-2-19-10-4-6-13-12(8-10)15(17)11-5-3-9(16)7-14(11)18-13/h3-8H,2H2,1H3,(H2,17,18).
What are the key properties of 6-chloro-2-ethoxyacridin-9-amine?
6-chloro-2-ethoxyacridin-9-amine has a molecular weight of 272.74 g/mol, XLogP of 4.02, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-ethoxyacridin-9-amine is sourced from PubChem (CID 71700026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).