11bH-indeno[2,1-c]isoquinoline-5,7-dione

C16H9NO2 — CID 21097994

IUPAC11bH-indeno[2,1-c]isoquinoline-5,7-dione
SMILESO=C1N=C2C(=O)c3ccccc3C2c2ccccc21
InChIInChI=1S/C16H9NO2/c18-15-11-7-3-1-5-9(11)13-10-6-2-4-8-12(10)16(19)17-14(13)15/h1-8,13H
InChIKeyDJKKALHEXOIKAV-UHFFFAOYSA-N
MW247.25 g/mol
LogP2.61
Rot. Bonds

About 11bH-indeno[2,1-c]isoquinoline-5,7-dione

11bH-indeno[2,1-c]isoquinoline-5,7-dione (PubChem CID 21097994) has the molecular formula C16H9NO2 and a molecular weight of 247.25 g/mol. Its IUPAC name is 11bH-indeno[2,1-c]isoquinoline-5,7-dione.

Molecular Properties

Compound Name11bH-indeno[2,1-c]isoquinoline-5,7-dione
PubChem CID21097994
Molecular FormulaC16H9NO2
Molecular Weight247.25 g/mol
Exact Mass247.06
IUPAC Name11bH-indeno[2,1-c]isoquinoline-5,7-dione
SMILESO=C1N=C2C(=O)c3ccccc3C2c2ccccc21
InChIInChI=1S/C16H9NO2/c18-15-11-7-3-1-5-9(11)13-10-6-2-4-8-12(10)16(19)17-14(13)15/h1-8,13H
InChIKeyDJKKALHEXOIKAV-UHFFFAOYSA-N
XLogP2.61
TPSA46.50 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.25
LogP ≤ 52.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 11bH-indeno[2,1-c]isoquinoline-5,7-dione?
The IUPAC name of 11bH-indeno[2,1-c]isoquinoline-5,7-dione (CID 21097994) is 11bH-indeno[2,1-c]isoquinoline-5,7-dione.
What is the SMILES notation for 11bH-indeno[2,1-c]isoquinoline-5,7-dione?
The canonical SMILES for 11bH-indeno[2,1-c]isoquinoline-5,7-dione is O=C1N=C2C(=O)c3ccccc3C2c2ccccc21.
What is the InChIKey of 11bH-indeno[2,1-c]isoquinoline-5,7-dione?
The InChIKey is DJKKALHEXOIKAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H9NO2/c18-15-11-7-3-1-5-9(11)13-10-6-2-4-8-12(10)16(19)17-14(13)15/h1-8,13H.
What are the key properties of 11bH-indeno[2,1-c]isoquinoline-5,7-dione?
11bH-indeno[2,1-c]isoquinoline-5,7-dione has a molecular weight of 247.25 g/mol, XLogP of 2.61, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 11bH-indeno[2,1-c]isoquinoline-5,7-dione is sourced from PubChem (CID 21097994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).