5,12-dimethylquinolino[2,3-b]acridine-7,14-dione

C22H16N2O2 — CID 2844779

IUPAC5,12-dimethylquinolino[2,3-b]acridine-7,14-dione
SMILESCn1c2ccccc2c(=O)c2cc3c(cc21)c(=O)c1ccccc1n3C
InChIInChI=1S/C22H16N2O2/c1-23-17-9-5-3-7-13(17)21(25)15-12-20-16(11-19(15)23)22(26)14-8-4-6-10-18(14)24(20)2/h3-12H,1-2H3
InChIKeySCZWJXTUYYSKGF-UHFFFAOYSA-N
MW340.38 g/mol
LogP3.70
Rot. Bonds

About 5,12-dimethylquinolino[2,3-b]acridine-7,14-dione

5,12-dimethylquinolino[2,3-b]acridine-7,14-dione (PubChem CID 2844779) has the molecular formula C22H16N2O2 and a molecular weight of 340.38 g/mol. Its IUPAC name is 5,12-dimethylquinolino[2,3-b]acridine-7,14-dione.

Molecular Properties

Compound Name5,12-dimethylquinolino[2,3-b]acridine-7,14-dione
PubChem CID2844779
Molecular FormulaC22H16N2O2
Molecular Weight340.38 g/mol
Exact Mass340.12
IUPAC Name5,12-dimethylquinolino[2,3-b]acridine-7,14-dione
SMILESCn1c2ccccc2c(=O)c2cc3c(cc21)c(=O)c1ccccc1n3C
InChIInChI=1S/C22H16N2O2/c1-23-17-9-5-3-7-13(17)21(25)15-12-20-16(11-19(15)23)22(26)14-8-4-6-10-18(14)24(20)2/h3-12H,1-2H3
InChIKeySCZWJXTUYYSKGF-UHFFFAOYSA-N
XLogP3.70
TPSA44.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.38
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

8-methyl-8-azapentacyclo[20.4.0.02,7.09,14.015,20]hexacosa-1(26),2,4,6,9,11,13,15,17,19,22,24-dodecaen-21-one
CID 167125984
10-methyl-2-phenylacridin-9-one
CID 18533849
5,12-diaminoquinolino[2,3-b]acridine-7,14-dione
CID 20821728
4-[2-(10-methyl-9-oxoacridin-3-yl)ethynyl]benzonitrile
CID 25011614
ethane;bis(9-methylcarbazole)
CID 159710949
2,9-bis(2-chlorophenyl)-5,12-dimethylquinolino[2,3-b]acridine-7,14-dione
CID 138622627
3-(1,3-benzodioxol-5-yl)-10-methylacridin-9-one
CID 24818813
2-[tert-butyl(dimethyl)silyl]oxy-10-methylacridin-9-one
CID 10664832
ethane;9-methylcarbazole;triphenylene
CID 142356751
10-methyl-2-(2-pyrrol-1-ylethoxy)acridin-9-one
CID 70576800
10-methyl-3-(1,3-thiazol-2-yl)acridin-9-one
CID 139804736
2,9-bis(1-benzofuran-2-yl)-5,12-dimethylquinolino[2,3-b]acridine-7,14-dione
CID 138622625

Frequently Asked Questions

What is the IUPAC name of 5,12-dimethylquinolino[2,3-b]acridine-7,14-dione?
The IUPAC name of 5,12-dimethylquinolino[2,3-b]acridine-7,14-dione (CID 2844779) is 5,12-dimethylquinolino[2,3-b]acridine-7,14-dione.
What is the SMILES notation for 5,12-dimethylquinolino[2,3-b]acridine-7,14-dione?
The canonical SMILES for 5,12-dimethylquinolino[2,3-b]acridine-7,14-dione is Cn1c2ccccc2c(=O)c2cc3c(cc21)c(=O)c1ccccc1n3C.
What is the InChIKey of 5,12-dimethylquinolino[2,3-b]acridine-7,14-dione?
The InChIKey is SCZWJXTUYYSKGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16N2O2/c1-23-17-9-5-3-7-13(17)21(25)15-12-20-16(11-19(15)23)22(26)14-8-4-6-10-18(14)24(20)2/h3-12H,1-2H3.
What are the key properties of 5,12-dimethylquinolino[2,3-b]acridine-7,14-dione?
5,12-dimethylquinolino[2,3-b]acridine-7,14-dione has a molecular weight of 340.38 g/mol, XLogP of 3.70, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5,12-dimethylquinolino[2,3-b]acridine-7,14-dione is sourced from PubChem (CID 2844779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).