2,7-dimethyl-10H-acridin-9-one

C15H13NO — CID 13293445

IUPAC2,7-dimethyl-10H-acridin-9-one
SMILESCc1ccc2[nH]c3ccc(C)cc3c(=O)c2c1
InChIInChI=1S/C15H13NO/c1-9-3-5-13-11(7-9)15(17)12-8-10(2)4-6-14(12)16-13/h3-8H,1-2H3,(H,16,17)
InChIKeyIBEGAUGEWHXHQH-UHFFFAOYSA-N
MW223.27 g/mol
LogP3.30
Rot. Bonds

About 2,7-dimethyl-10H-acridin-9-one

2,7-dimethyl-10H-acridin-9-one (PubChem CID 13293445) has the molecular formula C15H13NO and a molecular weight of 223.27 g/mol. Its IUPAC name is 2,7-dimethyl-10H-acridin-9-one.

Molecular Properties

Compound Name2,7-dimethyl-10H-acridin-9-one
PubChem CID13293445
Molecular FormulaC15H13NO
Molecular Weight223.27 g/mol
Exact Mass223.10
IUPAC Name2,7-dimethyl-10H-acridin-9-one
SMILESCc1ccc2[nH]c3ccc(C)cc3c(=O)c2c1
InChIInChI=1S/C15H13NO/c1-9-3-5-13-11(7-9)15(17)12-8-10(2)4-6-14(12)16-13/h3-8H,1-2H3,(H,16,17)
InChIKeyIBEGAUGEWHXHQH-UHFFFAOYSA-N
XLogP3.30
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.27
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 2,7-dimethyl-10H-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 2,7-dimethyl-10H-acridin-9-one?
The IUPAC name of 2,7-dimethyl-10H-acridin-9-one (CID 13293445) is 2,7-dimethyl-10H-acridin-9-one.
What is the SMILES notation for 2,7-dimethyl-10H-acridin-9-one?
The canonical SMILES for 2,7-dimethyl-10H-acridin-9-one is Cc1ccc2[nH]c3ccc(C)cc3c(=O)c2c1.
What is the InChIKey of 2,7-dimethyl-10H-acridin-9-one?
The InChIKey is IBEGAUGEWHXHQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NO/c1-9-3-5-13-11(7-9)15(17)12-8-10(2)4-6-14(12)16-13/h3-8H,1-2H3,(H,16,17).
What are the key properties of 2,7-dimethyl-10H-acridin-9-one?
2,7-dimethyl-10H-acridin-9-one has a molecular weight of 223.27 g/mol, XLogP of 3.30, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,7-dimethyl-10H-acridin-9-one is sourced from PubChem (CID 13293445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).