10-[6-(diethylamino)hexyl]acridin-9-one

C23H30N2O — CID 44566054

IUPAC10-[6-(diethylamino)hexyl]acridin-9-one
SMILESCCN(CC)CCCCCCn1c2ccccc2c(=O)c2ccccc21
InChIInChI=1S/C23H30N2O/c1-3-24(4-2)17-11-5-6-12-18-25-21-15-9-7-13-19(21)23(26)20-14-8-10-16-22(20)25/h7-10,13-16H,3-6,11-12,17-18H2,1-2H3
InChIKeyYHXSELHUXJAOLR-UHFFFAOYSA-N
MW350.51 g/mol
LogP5.06
Rot. Bonds9

About 10-[6-(diethylamino)hexyl]acridin-9-one

10-[6-(diethylamino)hexyl]acridin-9-one (PubChem CID 44566054) has the molecular formula C23H30N2O and a molecular weight of 350.51 g/mol. Its IUPAC name is 10-[6-(diethylamino)hexyl]acridin-9-one.

Molecular Properties

Compound Name10-[6-(diethylamino)hexyl]acridin-9-one
PubChem CID44566054
Molecular FormulaC23H30N2O
Molecular Weight350.51 g/mol
Exact Mass350.24
IUPAC Name10-[6-(diethylamino)hexyl]acridin-9-one
SMILESCCN(CC)CCCCCCn1c2ccccc2c(=O)c2ccccc21
InChIInChI=1S/C23H30N2O/c1-3-24(4-2)17-11-5-6-12-18-25-21-15-9-7-13-19(21)23(26)20-14-8-10-16-22(20)25/h7-10,13-16H,3-6,11-12,17-18H2,1-2H3
InChIKeyYHXSELHUXJAOLR-UHFFFAOYSA-N
XLogP5.06
TPSA25.24 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500350.51
LogP ≤ 55.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 10-[6-(diethylamino)hexyl]acridin-9-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 10-[6-(diethylamino)hexyl]acridin-9-one?
The IUPAC name of 10-[6-(diethylamino)hexyl]acridin-9-one (CID 44566054) is 10-[6-(diethylamino)hexyl]acridin-9-one.
What is the SMILES notation for 10-[6-(diethylamino)hexyl]acridin-9-one?
The canonical SMILES for 10-[6-(diethylamino)hexyl]acridin-9-one is CCN(CC)CCCCCCn1c2ccccc2c(=O)c2ccccc21.
What is the InChIKey of 10-[6-(diethylamino)hexyl]acridin-9-one?
The InChIKey is YHXSELHUXJAOLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N2O/c1-3-24(4-2)17-11-5-6-12-18-25-21-15-9-7-13-19(21)23(26)20-14-8-10-16-22(20)25/h7-10,13-16H,3-6,11-12,17-18H2,1-2H3.
What are the key properties of 10-[6-(diethylamino)hexyl]acridin-9-one?
10-[6-(diethylamino)hexyl]acridin-9-one has a molecular weight of 350.51 g/mol, XLogP of 5.06, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 10-[6-(diethylamino)hexyl]acridin-9-one is sourced from PubChem (CID 44566054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).