12-methylquinolino[7,6-a]carbazole-5,13-dione

C20H12N2O2 — CID 46193683

IUPAC12-methylquinolino[7,6-a]carbazole-5,13-dione
SMILESCn1c2ccccc2c2ccc3c(c21)C(=O)c1ncccc1C3=O
InChIInChI=1S/C20H12N2O2/c1-22-15-7-3-2-5-11(15)12-8-9-13-16(18(12)22)20(24)17-14(19(13)23)6-4-10-21-17/h2-10H,1H3
InChIKeyIBKPASQQVVLOAB-UHFFFAOYSA-N
MW312.33 g/mol
LogP3.50
Rot. Bonds

About 12-methylquinolino[7,6-a]carbazole-5,13-dione

12-methylquinolino[7,6-a]carbazole-5,13-dione (PubChem CID 46193683) has the molecular formula C20H12N2O2 and a molecular weight of 312.33 g/mol. Its IUPAC name is 12-methylquinolino[7,6-a]carbazole-5,13-dione.

Molecular Properties

Compound Name12-methylquinolino[7,6-a]carbazole-5,13-dione
PubChem CID46193683
Molecular FormulaC20H12N2O2
Molecular Weight312.33 g/mol
Exact Mass312.09
IUPAC Name12-methylquinolino[7,6-a]carbazole-5,13-dione
SMILESCn1c2ccccc2c2ccc3c(c21)C(=O)c1ncccc1C3=O
InChIInChI=1S/C20H12N2O2/c1-22-15-7-3-2-5-11(15)12-8-9-13-16(18(12)22)20(24)17-14(19(13)23)6-4-10-21-17/h2-10H,1H3
InChIKeyIBKPASQQVVLOAB-UHFFFAOYSA-N
XLogP3.50
TPSA51.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.33
LogP ≤ 53.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

phenanthro[9,10-g]quinoline-9,14-dione
CID 71437214
6-(1,2-dimethylindol-3-yl)quinoline-5,8-dione
CID 22461862
naphtho[1,2-h]quinoline-11,12-dione
CID 126542594
11-methyl-5-pyridin-2-ylbenzo[a]carbazole
CID 58410525
2-(dimethylamino)naphtho[2,1-g]quinoline-7,12-dione
CID 23239458
9-methylpyrido[2,3-b]indole
CID 12596580
4,7-phenanthroline-5,6-dione
CID 6764
11-acetylindolizino[3,2-g]quinoline-5,12-dione
CID 44567516
1-ethyl-9-methylcarbazole
CID 21455608
9-methyl-1-(3,4,5-trimethylphenyl)pyrido[3,4-b]indole
CID 126583667
7-methylbenzo[b][1,10]phenanthroline-5,6-dione
CID 176653841
13-hydroxy-23-methyl-3,5,13,23-tetrazahexacyclo[14.7.0.02,10.04,9.011,15.017,22]tricosa-1,4(9),5,7,10,15,17,19,21-nonaene-12,14-dione
CID 155813737

Frequently Asked Questions

What is the IUPAC name of 12-methylquinolino[7,6-a]carbazole-5,13-dione?
The IUPAC name of 12-methylquinolino[7,6-a]carbazole-5,13-dione (CID 46193683) is 12-methylquinolino[7,6-a]carbazole-5,13-dione.
What is the SMILES notation for 12-methylquinolino[7,6-a]carbazole-5,13-dione?
The canonical SMILES for 12-methylquinolino[7,6-a]carbazole-5,13-dione is Cn1c2ccccc2c2ccc3c(c21)C(=O)c1ncccc1C3=O.
What is the InChIKey of 12-methylquinolino[7,6-a]carbazole-5,13-dione?
The InChIKey is IBKPASQQVVLOAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H12N2O2/c1-22-15-7-3-2-5-11(15)12-8-9-13-16(18(12)22)20(24)17-14(19(13)23)6-4-10-21-17/h2-10H,1H3.
What are the key properties of 12-methylquinolino[7,6-a]carbazole-5,13-dione?
12-methylquinolino[7,6-a]carbazole-5,13-dione has a molecular weight of 312.33 g/mol, XLogP of 3.50, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 12-methylquinolino[7,6-a]carbazole-5,13-dione is sourced from PubChem (CID 46193683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).