4-methyl-7,8,9,10-tetrahydropyrido[2,3-b]acridine-5,12-dione

C17H14N2O2 — CID 15870608

IUPAC4-methyl-7,8,9,10-tetrahydropyrido[2,3-b]acridine-5,12-dione
SMILESCc1ccnc2c1C(=O)c1nc3c(cc1C2=O)CCCC3
InChIInChI=1S/C17H14N2O2/c1-9-6-7-18-15-13(9)17(21)14-11(16(15)20)8-10-4-2-3-5-12(10)19-14/h6-8H,2-5H2,1H3
InChIKeyWAPRLYBLBILKTO-UHFFFAOYSA-N
MW278.31 g/mol
LogP2.44
Rot. Bonds

About 4-methyl-7,8,9,10-tetrahydropyrido[2,3-b]acridine-5,12-dione

4-methyl-7,8,9,10-tetrahydropyrido[2,3-b]acridine-5,12-dione (PubChem CID 15870608) has the molecular formula C17H14N2O2 and a molecular weight of 278.31 g/mol. Its IUPAC name is 4-methyl-7,8,9,10-tetrahydropyrido[2,3-b]acridine-5,12-dione.

Molecular Properties

Compound Name4-methyl-7,8,9,10-tetrahydropyrido[2,3-b]acridine-5,12-dione
PubChem CID15870608
Molecular FormulaC17H14N2O2
Molecular Weight278.31 g/mol
Exact Mass278.11
IUPAC Name4-methyl-7,8,9,10-tetrahydropyrido[2,3-b]acridine-5,12-dione
SMILESCc1ccnc2c1C(=O)c1nc3c(cc1C2=O)CCCC3
InChIInChI=1S/C17H14N2O2/c1-9-6-7-18-15-13(9)17(21)14-11(16(15)20)8-10-4-2-3-5-12(10)19-14/h6-8H,2-5H2,1H3
InChIKeyWAPRLYBLBILKTO-UHFFFAOYSA-N
XLogP2.44
TPSA59.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'quinone_A(370)', 'substructure': 'N/A'}

Analyze 4-methyl-7,8,9,10-tetrahydropyrido[2,3-b]acridine-5,12-dione 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 4-methyl-7,8,9,10-tetrahydropyrido[2,3-b]acridine-5,12-dione?
The IUPAC name of 4-methyl-7,8,9,10-tetrahydropyrido[2,3-b]acridine-5,12-dione (CID 15870608) is 4-methyl-7,8,9,10-tetrahydropyrido[2,3-b]acridine-5,12-dione.
What is the SMILES notation for 4-methyl-7,8,9,10-tetrahydropyrido[2,3-b]acridine-5,12-dione?
The canonical SMILES for 4-methyl-7,8,9,10-tetrahydropyrido[2,3-b]acridine-5,12-dione is Cc1ccnc2c1C(=O)c1nc3c(cc1C2=O)CCCC3.
What is the InChIKey of 4-methyl-7,8,9,10-tetrahydropyrido[2,3-b]acridine-5,12-dione?
The InChIKey is WAPRLYBLBILKTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2O2/c1-9-6-7-18-15-13(9)17(21)14-11(16(15)20)8-10-4-2-3-5-12(10)19-14/h6-8H,2-5H2,1H3.
What are the key properties of 4-methyl-7,8,9,10-tetrahydropyrido[2,3-b]acridine-5,12-dione?
4-methyl-7,8,9,10-tetrahydropyrido[2,3-b]acridine-5,12-dione has a molecular weight of 278.31 g/mol, XLogP of 2.44, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-7,8,9,10-tetrahydropyrido[2,3-b]acridine-5,12-dione is sourced from PubChem (CID 15870608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).