2-chloro-10-(4-morpholin-4-ylbutyl)acridin-9-one

C21H23ClN2O2 — CID 11846559

IUPAC2-chloro-10-(4-morpholin-4-ylbutyl)acridin-9-one
SMILESO=c1c2ccccc2n(CCCCN2CCOCC2)c2ccc(Cl)cc12
InChIInChI=1S/C21H23ClN2O2/c22-16-7-8-20-18(15-16)21(25)17-5-1-2-6-19(17)24(20)10-4-3-9-23-11-13-26-14-12-23/h1-2,5-8,15H,3-4,9-14H2
InChIKeyGTVWTVKEPVTYGI-UHFFFAOYSA-N
MW370.88 g/mol
LogP3.92
Rot. Bonds5

About 2-chloro-10-(4-morpholin-4-ylbutyl)acridin-9-one

2-chloro-10-(4-morpholin-4-ylbutyl)acridin-9-one (PubChem CID 11846559) has the molecular formula C21H23ClN2O2 and a molecular weight of 370.88 g/mol. Its IUPAC name is 2-chloro-10-(4-morpholin-4-ylbutyl)acridin-9-one.

Molecular Properties

Compound Name2-chloro-10-(4-morpholin-4-ylbutyl)acridin-9-one
PubChem CID11846559
Molecular FormulaC21H23ClN2O2
Molecular Weight370.88 g/mol
Exact Mass370.14
IUPAC Name2-chloro-10-(4-morpholin-4-ylbutyl)acridin-9-one
SMILESO=c1c2ccccc2n(CCCCN2CCOCC2)c2ccc(Cl)cc12
InChIInChI=1S/C21H23ClN2O2/c22-16-7-8-20-18(15-16)21(25)17-5-1-2-6-19(17)24(20)10-4-3-9-23-11-13-26-14-12-23/h1-2,5-8,15H,3-4,9-14H2
InChIKeyGTVWTVKEPVTYGI-UHFFFAOYSA-N
XLogP3.92
TPSA34.47 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.88
LogP ≤ 53.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-chloro-10-(4-morpholin-4-ylbutyl)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 2-chloro-10-(4-morpholin-4-ylbutyl)acridin-9-one?
The IUPAC name of 2-chloro-10-(4-morpholin-4-ylbutyl)acridin-9-one (CID 11846559) is 2-chloro-10-(4-morpholin-4-ylbutyl)acridin-9-one.
What is the SMILES notation for 2-chloro-10-(4-morpholin-4-ylbutyl)acridin-9-one?
The canonical SMILES for 2-chloro-10-(4-morpholin-4-ylbutyl)acridin-9-one is O=c1c2ccccc2n(CCCCN2CCOCC2)c2ccc(Cl)cc12.
What is the InChIKey of 2-chloro-10-(4-morpholin-4-ylbutyl)acridin-9-one?
The InChIKey is GTVWTVKEPVTYGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23ClN2O2/c22-16-7-8-20-18(15-16)21(25)17-5-1-2-6-19(17)24(20)10-4-3-9-23-11-13-26-14-12-23/h1-2,5-8,15H,3-4,9-14H2.
What are the key properties of 2-chloro-10-(4-morpholin-4-ylbutyl)acridin-9-one?
2-chloro-10-(4-morpholin-4-ylbutyl)acridin-9-one has a molecular weight of 370.88 g/mol, XLogP of 3.92, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-10-(4-morpholin-4-ylbutyl)acridin-9-one is sourced from PubChem (CID 11846559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).