9-ethoxy-9-phenyl-10H-acridine

C21H19NO — CID 14400633

IUPAC9-ethoxy-9-phenyl-10H-acridine
SMILESCCOC1(c2ccccc2)c2ccccc2Nc2ccccc21
InChIInChI=1S/C21H19NO/c1-2-23-21(16-10-4-3-5-11-16)17-12-6-8-14-19(17)22-20-15-9-7-13-18(20)21/h3-15,22H,2H2,1H3
InChIKeyAWLKTPXFCKGTFP-UHFFFAOYSA-N
MW301.39 g/mol
LogP5.07
Rot. Bonds3

About 9-ethoxy-9-phenyl-10H-acridine

9-ethoxy-9-phenyl-10H-acridine (PubChem CID 14400633) has the molecular formula C21H19NO and a molecular weight of 301.39 g/mol. Its IUPAC name is 9-ethoxy-9-phenyl-10H-acridine.

Molecular Properties

Compound Name9-ethoxy-9-phenyl-10H-acridine
PubChem CID14400633
Molecular FormulaC21H19NO
Molecular Weight301.39 g/mol
Exact Mass301.15
IUPAC Name9-ethoxy-9-phenyl-10H-acridine
SMILESCCOC1(c2ccccc2)c2ccccc2Nc2ccccc21
InChIInChI=1S/C21H19NO/c1-2-23-21(16-10-4-3-5-11-16)17-12-6-8-14-19(17)22-20-15-9-7-13-18(20)21/h3-15,22H,2H2,1H3
InChIKeyAWLKTPXFCKGTFP-UHFFFAOYSA-N
XLogP5.07
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500301.39
LogP ≤ 55.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 9-ethoxy-9-phenyl-10H-acridine?
The IUPAC name of 9-ethoxy-9-phenyl-10H-acridine (CID 14400633) is 9-ethoxy-9-phenyl-10H-acridine.
What is the SMILES notation for 9-ethoxy-9-phenyl-10H-acridine?
The canonical SMILES for 9-ethoxy-9-phenyl-10H-acridine is CCOC1(c2ccccc2)c2ccccc2Nc2ccccc21.
What is the InChIKey of 9-ethoxy-9-phenyl-10H-acridine?
The InChIKey is AWLKTPXFCKGTFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19NO/c1-2-23-21(16-10-4-3-5-11-16)17-12-6-8-14-19(17)22-20-15-9-7-13-18(20)21/h3-15,22H,2H2,1H3.
What are the key properties of 9-ethoxy-9-phenyl-10H-acridine?
9-ethoxy-9-phenyl-10H-acridine has a molecular weight of 301.39 g/mol, XLogP of 5.07, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-ethoxy-9-phenyl-10H-acridine is sourced from PubChem (CID 14400633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).