3,9-dimethyl-5,12-dihydroquinolino[2,3-b]acridine-7,14-dione

C22H16N2O2 — CID 59728395

IUPAC3,9-dimethyl-5,12-dihydroquinolino[2,3-b]acridine-7,14-dione
SMILESCc1ccc2c(=O)c3cc4[nH]c5ccc(C)cc5c(=O)c4cc3[nH]c2c1
InChIInChI=1S/C22H16N2O2/c1-11-4-6-17-14(7-11)22(26)16-10-20-15(9-19(16)23-17)21(25)13-5-3-12(2)8-18(13)24-20/h3-10H,1-2H3,(H,23,26)(H,24,25)
InChIKeyASYKCBFYJPUEQQ-UHFFFAOYSA-N
MW340.38 g/mol
LogP4.29
Rot. Bonds

About 3,9-dimethyl-5,12-dihydroquinolino[2,3-b]acridine-7,14-dione

3,9-dimethyl-5,12-dihydroquinolino[2,3-b]acridine-7,14-dione (PubChem CID 59728395) has the molecular formula C22H16N2O2 and a molecular weight of 340.38 g/mol. Its IUPAC name is 3,9-dimethyl-5,12-dihydroquinolino[2,3-b]acridine-7,14-dione.

Molecular Properties

Compound Name3,9-dimethyl-5,12-dihydroquinolino[2,3-b]acridine-7,14-dione
PubChem CID59728395
Molecular FormulaC22H16N2O2
Molecular Weight340.38 g/mol
Exact Mass340.12
IUPAC Name3,9-dimethyl-5,12-dihydroquinolino[2,3-b]acridine-7,14-dione
SMILESCc1ccc2c(=O)c3cc4[nH]c5ccc(C)cc5c(=O)c4cc3[nH]c2c1
InChIInChI=1S/C22H16N2O2/c1-11-4-6-17-14(7-11)22(26)16-10-20-15(9-19(16)23-17)21(25)13-5-3-12(2)8-18(13)24-20/h3-10H,1-2H3,(H,23,26)(H,24,25)
InChIKeyASYKCBFYJPUEQQ-UHFFFAOYSA-N
XLogP4.29
TPSA65.72 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.38
LogP ≤ 54.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 3,9-dimethyl-5,12-dihydroquinolino[2,3-b]acridine-7,14-dione with MolForge

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Related Compounds

2,7-dimethyl-10H-acridin-9-one
CID 13293445
2-chloro-9-methyl-5,12-dihydroquinolino[2,3-b]acridine-7,14-dione
CID 59775439
2-methyl-6-nitro-10H-acridin-9-one
CID 154179171
2,8-dimethyl-5,11-dihydroquinolino[3,2-b]quinoline-6,12-dione
CID 24764365
2-methoxy-7-methyl-10H-acridin-9-one
CID 24773760
3,6-dimethyl-9H-carbazole
CID 144942624
5,12-dihydroquinolino[2,3-b]acridine-7,14-dione;ethane
CID 90939428
6-chloro-5-(dimethylamino)-2-methyl-10H-acridin-9-one
CID 155297676
(2S)-2-aminopropanoic acid;2-methyl-10H-acridin-9-one
CID 157209438
2,9-dimethyl-14-methylidene-5,12-dihydroquinolino[2,3-b]acridin-7-one
CID 89357147
8-methyl-5,11-dihydroindolo[3,2-b]carbazol-2-amine
CID 123384681
2-methyl-5,10-dihydroindolo[3,2-b]quinolin-11-one
CID 10681996

Frequently Asked Questions

What is the IUPAC name of 3,9-dimethyl-5,12-dihydroquinolino[2,3-b]acridine-7,14-dione?
The IUPAC name of 3,9-dimethyl-5,12-dihydroquinolino[2,3-b]acridine-7,14-dione (CID 59728395) is 3,9-dimethyl-5,12-dihydroquinolino[2,3-b]acridine-7,14-dione.
What is the SMILES notation for 3,9-dimethyl-5,12-dihydroquinolino[2,3-b]acridine-7,14-dione?
The canonical SMILES for 3,9-dimethyl-5,12-dihydroquinolino[2,3-b]acridine-7,14-dione is Cc1ccc2c(=O)c3cc4[nH]c5ccc(C)cc5c(=O)c4cc3[nH]c2c1.
What is the InChIKey of 3,9-dimethyl-5,12-dihydroquinolino[2,3-b]acridine-7,14-dione?
The InChIKey is ASYKCBFYJPUEQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16N2O2/c1-11-4-6-17-14(7-11)22(26)16-10-20-15(9-19(16)23-17)21(25)13-5-3-12(2)8-18(13)24-20/h3-10H,1-2H3,(H,23,26)(H,24,25).
What are the key properties of 3,9-dimethyl-5,12-dihydroquinolino[2,3-b]acridine-7,14-dione?
3,9-dimethyl-5,12-dihydroquinolino[2,3-b]acridine-7,14-dione has a molecular weight of 340.38 g/mol, XLogP of 4.29, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,9-dimethyl-5,12-dihydroquinolino[2,3-b]acridine-7,14-dione is sourced from PubChem (CID 59728395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).