11bH-azeto[1,2-f]phenanthridine-1,2-dione

C15H9NO2 — CID 10868263

IUPAC11bH-azeto[1,2-f]phenanthridine-1,2-dione
SMILESO=C1C(=O)N2c3ccccc3-c3ccccc3C12
InChIInChI=1S/C15H9NO2/c17-14-13-11-7-2-1-5-9(11)10-6-3-4-8-12(10)16(13)15(14)18/h1-8,13H
InChIKeyURFFCGMOPFKERW-UHFFFAOYSA-N
MW235.24 g/mol
LogP2.32
Rot. Bonds

About 11bH-azeto[1,2-f]phenanthridine-1,2-dione

11bH-azeto[1,2-f]phenanthridine-1,2-dione (PubChem CID 10868263) has the molecular formula C15H9NO2 and a molecular weight of 235.24 g/mol. Its IUPAC name is 11bH-azeto[1,2-f]phenanthridine-1,2-dione.

Molecular Properties

Compound Name11bH-azeto[1,2-f]phenanthridine-1,2-dione
PubChem CID10868263
Molecular FormulaC15H9NO2
Molecular Weight235.24 g/mol
Exact Mass235.06
IUPAC Name11bH-azeto[1,2-f]phenanthridine-1,2-dione
SMILESO=C1C(=O)N2c3ccccc3-c3ccccc3C12
InChIInChI=1S/C15H9NO2/c17-14-13-11-7-2-1-5-9(11)10-6-3-4-8-12(10)16(13)15(14)18/h1-8,13H
InChIKeyURFFCGMOPFKERW-UHFFFAOYSA-N
XLogP2.32
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.24
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 11bH-azeto[1,2-f]phenanthridine-1,2-dione?
The IUPAC name of 11bH-azeto[1,2-f]phenanthridine-1,2-dione (CID 10868263) is 11bH-azeto[1,2-f]phenanthridine-1,2-dione.
What is the SMILES notation for 11bH-azeto[1,2-f]phenanthridine-1,2-dione?
The canonical SMILES for 11bH-azeto[1,2-f]phenanthridine-1,2-dione is O=C1C(=O)N2c3ccccc3-c3ccccc3C12.
What is the InChIKey of 11bH-azeto[1,2-f]phenanthridine-1,2-dione?
The InChIKey is URFFCGMOPFKERW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9NO2/c17-14-13-11-7-2-1-5-9(11)10-6-3-4-8-12(10)16(13)15(14)18/h1-8,13H.
What are the key properties of 11bH-azeto[1,2-f]phenanthridine-1,2-dione?
11bH-azeto[1,2-f]phenanthridine-1,2-dione has a molecular weight of 235.24 g/mol, XLogP of 2.32, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 11bH-azeto[1,2-f]phenanthridine-1,2-dione is sourced from PubChem (CID 10868263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).