7-acetylbenzo[a]quinolizin-6-one

C15H11NO2 — CID 132564755

IUPAC7-acetylbenzo[a]quinolizin-6-one
SMILESCC(=O)c1c(=O)n2ccccc2c2ccccc12
InChIInChI=1S/C15H11NO2/c1-10(17)14-12-7-3-2-6-11(12)13-8-4-5-9-16(13)15(14)18/h2-9H,1H3
InChIKeyGOKUNTKVMOAVKG-UHFFFAOYSA-N
MW237.26 g/mol
LogP2.66
Rot. Bonds1

About 7-acetylbenzo[a]quinolizin-6-one

7-acetylbenzo[a]quinolizin-6-one (PubChem CID 132564755) has the molecular formula C15H11NO2 and a molecular weight of 237.26 g/mol. Its IUPAC name is 7-acetylbenzo[a]quinolizin-6-one.

Molecular Properties

Compound Name7-acetylbenzo[a]quinolizin-6-one
PubChem CID132564755
Molecular FormulaC15H11NO2
Molecular Weight237.26 g/mol
Exact Mass237.08
IUPAC Name7-acetylbenzo[a]quinolizin-6-one
SMILESCC(=O)c1c(=O)n2ccccc2c2ccccc12
InChIInChI=1S/C15H11NO2/c1-10(17)14-12-7-3-2-6-11(12)13-8-4-5-9-16(13)15(14)18/h2-9H,1H3
InChIKeyGOKUNTKVMOAVKG-UHFFFAOYSA-N
XLogP2.66
TPSA38.55 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.26
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Related Compounds

N-methylphenanthridone
CID 19009330
N-butyl-3-acetyl-2-pyridone
CID 82526873
Quinolizine-2,4-dione
CID 154016772
2-acetyl-7-fluoro-4H-quinolizin-4-one
CID 118627550
2-Acetyl-7-fluoro-3-methylquinolizin-4-one
CID 129248568
3,3'-(1-oxo-2-butene-1,3-diyl)bis(1-butyl-2(1H)-pyridinone)
CID 5718804
6-acetyl-7-ethyl-2,3-dihydro-1H-indolizin-5-one
CID 86102467
3-Acetyl-1,4-dimethylpyridin-2-one
CID 12554602
1,4-dimethyl-8H-quinoline-2,7-dione
CID 19829051
2-Acetyl-7-isocyanoquinolizin-4-one
CID 21364097
2-Acetyl-7-methylquinolizin-4-one
CID 21364098
4-Methyl-2-oxoquinolizine-1-carboxamide
CID 23044806

Frequently Asked Questions

What is the IUPAC name of 7-acetylbenzo[a]quinolizin-6-one?
The IUPAC name of 7-acetylbenzo[a]quinolizin-6-one (CID 132564755) is 7-acetylbenzo[a]quinolizin-6-one.
What is the SMILES notation for 7-acetylbenzo[a]quinolizin-6-one?
The canonical SMILES for 7-acetylbenzo[a]quinolizin-6-one is CC(=O)c1c(=O)n2ccccc2c2ccccc12.
What is the InChIKey of 7-acetylbenzo[a]quinolizin-6-one?
The InChIKey is GOKUNTKVMOAVKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11NO2/c1-10(17)14-12-7-3-2-6-11(12)13-8-4-5-9-16(13)15(14)18/h2-9H,1H3.
What are the key properties of 7-acetylbenzo[a]quinolizin-6-one?
7-acetylbenzo[a]quinolizin-6-one has a molecular weight of 237.26 g/mol, XLogP of 2.66, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-acetylbenzo[a]quinolizin-6-one is sourced from PubChem (CID 132564755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).