benzo[k]phenanthridine-6,8-dione

C17H9NO2 — CID 19744958

IUPACbenzo[k]phenanthridine-6,8-dione
SMILESO=C1N=c2ccccc2=C2C1=CC(=O)c1ccccc12
InChIInChI=1S/C17H9NO2/c19-15-9-13-16(11-6-2-1-5-10(11)15)12-7-3-4-8-14(12)18-17(13)20/h1-9H
InChIKeyNFFRSZOODHPVCT-UHFFFAOYSA-N
MW259.26 g/mol
LogP1.17
Rot. Bonds

About benzo[k]phenanthridine-6,8-dione

benzo[k]phenanthridine-6,8-dione (PubChem CID 19744958) has the molecular formula C17H9NO2 and a molecular weight of 259.26 g/mol. Its IUPAC name is benzo[k]phenanthridine-6,8-dione.

Molecular Properties

Compound Namebenzo[k]phenanthridine-6,8-dione
PubChem CID19744958
Molecular FormulaC17H9NO2
Molecular Weight259.26 g/mol
Exact Mass259.06
IUPAC Namebenzo[k]phenanthridine-6,8-dione
SMILESO=C1N=c2ccccc2=C2C1=CC(=O)c1ccccc12
InChIInChI=1S/C17H9NO2/c19-15-9-13-16(11-6-2-1-5-10(11)15)12-7-3-4-8-14(12)18-17(13)20/h1-9H
InChIKeyNFFRSZOODHPVCT-UHFFFAOYSA-N
XLogP1.17
TPSA46.50 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.26
LogP ≤ 51.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of benzo[k]phenanthridine-6,8-dione?
The IUPAC name of benzo[k]phenanthridine-6,8-dione (CID 19744958) is benzo[k]phenanthridine-6,8-dione.
What is the SMILES notation for benzo[k]phenanthridine-6,8-dione?
The canonical SMILES for benzo[k]phenanthridine-6,8-dione is O=C1N=c2ccccc2=C2C1=CC(=O)c1ccccc12.
What is the InChIKey of benzo[k]phenanthridine-6,8-dione?
The InChIKey is NFFRSZOODHPVCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H9NO2/c19-15-9-13-16(11-6-2-1-5-10(11)15)12-7-3-4-8-14(12)18-17(13)20/h1-9H.
What are the key properties of benzo[k]phenanthridine-6,8-dione?
benzo[k]phenanthridine-6,8-dione has a molecular weight of 259.26 g/mol, XLogP of 1.17, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for benzo[k]phenanthridine-6,8-dione is sourced from PubChem (CID 19744958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).