naphtho[2,3-b]indolizine-6,11-dione

C16H9NO2 — CID 11064724

IUPACnaphtho[2,3-b]indolizine-6,11-dione
SMILESO=C1c2ccccc2C(=O)c2c1cc1ccccn21
InChIInChI=1S/C16H9NO2/c18-15-11-6-1-2-7-12(11)16(19)14-13(15)9-10-5-3-4-8-17(10)14/h1-9H
InChIKeyHQOPRYVUHZJKAO-UHFFFAOYSA-N
MW247.25 g/mol
LogP2.71
Rot. Bonds

About naphtho[2,3-b]indolizine-6,11-dione

naphtho[2,3-b]indolizine-6,11-dione (PubChem CID 11064724) has the molecular formula C16H9NO2 and a molecular weight of 247.25 g/mol. Its IUPAC name is naphtho[2,3-b]indolizine-6,11-dione.

Molecular Properties

Compound Namenaphtho[2,3-b]indolizine-6,11-dione
PubChem CID11064724
Molecular FormulaC16H9NO2
Molecular Weight247.25 g/mol
Exact Mass247.06
IUPAC Namenaphtho[2,3-b]indolizine-6,11-dione
SMILESO=C1c2ccccc2C(=O)c2c1cc1ccccn21
InChIInChI=1S/C16H9NO2/c18-15-11-6-1-2-7-12(11)16(19)14-13(15)9-10-5-3-4-8-17(10)14/h1-9H
InChIKeyHQOPRYVUHZJKAO-UHFFFAOYSA-N
XLogP2.71
TPSA38.55 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.25
LogP ≤ 52.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of naphtho[2,3-b]indolizine-6,11-dione?
The IUPAC name of naphtho[2,3-b]indolizine-6,11-dione (CID 11064724) is naphtho[2,3-b]indolizine-6,11-dione.
What is the SMILES notation for naphtho[2,3-b]indolizine-6,11-dione?
The canonical SMILES for naphtho[2,3-b]indolizine-6,11-dione is O=C1c2ccccc2C(=O)c2c1cc1ccccn21.
What is the InChIKey of naphtho[2,3-b]indolizine-6,11-dione?
The InChIKey is HQOPRYVUHZJKAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H9NO2/c18-15-11-6-1-2-7-12(11)16(19)14-13(15)9-10-5-3-4-8-17(10)14/h1-9H.
What are the key properties of naphtho[2,3-b]indolizine-6,11-dione?
naphtho[2,3-b]indolizine-6,11-dione has a molecular weight of 247.25 g/mol, XLogP of 2.71, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for naphtho[2,3-b]indolizine-6,11-dione is sourced from PubChem (CID 11064724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).